Dataset Viewer
Auto-converted to Parquet Duplicate
property_id
string
property_hash
string
last_modified
timestamp[us]
dataset_id
string
multiplicity
int32
software
string
method
string
energy
float64
atomic_forces
list
cauchy_stress
list
cauchy_stress_volume_normalized
bool
electronic_band_gap
float64
electronic_band_gap_type
string
formation_energy
float64
adsorption_energy
float64
atomization_energy
float64
max_force_norm
float64
mean_force_norm
float64
energy_above_hull
float64
configuration_id
string
configuration_hash
string
structure_hash
string
cell
list
positions
list
pbc
list
chemical_formula_hill
string
chemical_formula_reduced
string
chemical_formula_anonymous
string
elements
list
elements_ratios
list
atomic_numbers
list
nsites
int32
nelements
int32
nperiodic_dimensions
int32
dimension_types
list
names
list
labels
list
property_metadata_path
string
configuration_metadata_path
string
hash
string
configuration_metadata
string
property_metadata
string
PO_1001602134991212754755606
10016021349912127547556063763298866726652518536883148242537395519866162902162868747792816691260531782915183692236123847096897098372640801878083588086566799
2025-04-16T18:10:42
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-23,075.41866
[ [ 0.2919117280756722, 1.3901537091452199, 0.34415864506533733 ], [ -0.32054844202094956, -1.1015430231900856, 0.5571916901347186 ], [ 0.9454584182987922, 0.3463186306447937, 0.5364436415327196 ], [ 0.6071634360265847, 0.016032898555379392, 0.5117692579963227 ], [ -0.5671953467143507, -0.43449005960969583, -1.0010894241108363 ], [ 1.1550698364081204, -1.9875690564609951, 1.1014075259397138 ], [ 0.4042811147611479, -0.686326483281284, -0.4627979291845261 ], [ 0.018588834354138595, -1.1594129475149146, -0.3749427461740023 ], [ -1.0155261804834677, -0.3616444752371324, 0.36738369653276687 ], [ 1.1154038519710041, 1.9315451857560324, 0.6902214507307762 ], [ -0.3607209342061352, -1.7385780750472146, -0.689226690082411 ], [ 1.8971180855192495, 0.4081544849259511, 0.5460752591725263 ], [ -0.7594253215278821, 1.8226701883111698, 0.38546756580202846 ], [ 0.35289191850628426, -0.856191441356975, -0.253864254437589 ], [ 0.6647081155284149, -0.45726902430407973, 0.8480199544284803 ], [ 0.4770333680105901, -0.7656301699969953, 1.312599145378805 ], [ -0.18124312755947442, 0.7393982108576526, -1.1173072412395098 ], [ -0.9649556241625392, -0.09170952699595787, -0.5995938448535367 ], [ 0.13701934472133143, -1.122154546099585, 0.9373411816925529 ], [ -0.309601189788823, 0.06678934579095464, 1.0489328090186838 ], [ -0.8269991115520138, 1.382031587438872, -0.5484851561891011 ], [ 0.9926307447180812, -0.3333173223724009, -1.2738253344877801 ], [ 0.10049987897501216, 0.37471571757423316, -1.6547998937428499 ], [ -0.07232030755565717, 0.07981379401122876, 0.8445880430471467 ], [ -2.2175199745369505, 0.6048653820914364, -0.34001068085234243 ], [ 0.1554703678303101, 0.5960290073271514, -0.21507064603559867 ], [ -0.020495566059560412, -0.5547396269908934, -2.322380962355998 ], [ 0.1507737297419956, -1.8841813119903925, 0.8084904956838638 ], [ 0.921718374435737, -0.2162430700615862, 1.16759343331203 ], [ 0.500718390219794, -0.14299047971684334, -0.9723696634637182 ], [ -1.2033780771578506, -0.41275290679103593, 0.262356101088974 ], [ 0.31655371568503543, 0.46047493552777236, -0.4172407711273544 ], [ -0.35660665147283427, 0.9350539263997492, 0.1555174190576688 ], [ -1.0857492374294802, 1.0813996985593857, -0.4953946595438955 ], [ 1.8741246906411655, -0.33337671490529636, 0.15247888679031782 ], [ 0.23216438264607114, -1.3809306401407846, 0.9828672293753508 ], [ 0.03318191393023506, 0.170157806971656, 0.8255070991347317 ], [ 0.5082293601915427, 0.10064463220453648, -0.8612786303434201 ], [ -0.8411237357387792, -1.6118590924594605, 1.6780113183520824 ], [ 1.409602064007884, 2.1656715788719088, -0.6201081799819342 ], [ -0.8940478818697715, 1.0601623686149626, -0.5793029387774601 ], [ -1.0186971246748064, 0.04280581825408134, 0.2722196324286581 ], [ -0.3650028530063098, -0.0923643875209996, 0.11155126097260464 ], [ -0.3698738120353304, -1.23010600251345, 1.4500712617470146 ], [ -0.20556989765658748, 0.32839031324740114, -2.0894709591670844 ], [ -1.1076895075684317, 0.6293682729029795, -0.7133577990646608 ], [ 0.5544148963889587, 0.9104829012972219, -0.3521943776329281 ], [ -0.06558529716952928, -2.480263284087139, 0.44330997929993177 ], [ 0.5010840013963193, 0.8281342545508591, -0.1532476472810421 ], [ 0.5812590357050288, -0.08215555673681962, 0.7508733110120054 ], [ 0.06820268238544003, -0.7418343331484929, -0.2179461702256523 ], [ -1.183138850298709, 0.3881374015664702, 0.7559587002247263 ], [ 1.5476153980459846, 1.4506983543345988, 0.1638922804169871 ], [ -2.161265218574239, 0.3558222072396571, -0.6384895261367368 ], [ 0.6741445862744223, 0.02059223961959798, 1.0367956492443926 ], [ 0.8929055397760296, 1.323859301128394, 0.4808049224047152 ], [ -0.6425806689221565, 0.11406014554400513, -1.1359390130524947 ], [ -1.2804857828196237, -0.8539828618869679, -0.5229610223443951 ], [ 1.4057189236428644, -0.3942864570501363, 0.08030873178535726 ], [ -0.0979033197121946, 1.2272898708562918, -0.5332158759138057 ], [ 0.016570516677822354, -1.0315613930336354, 0.6670635051122026 ], [ -1.0534592399348042, -0.47509244060441025, -0.05402329365535539 ], [ 0.39460681677302684, -0.20562286242618252, 0.8831487093071317 ], [ -0.9522875311396376, -0.1297456877706325, -0.2607743570960189 ], [ 1.040828170828513, -0.3532547014669572, 0.8157111878649677 ], [ -0.9405254956315563, 1.163171646382439, -1.3471329464863742 ], [ 0.857179002910444, -0.08627189635437671, -0.6532186171842691 ], [ -1.8195036149988755, -0.9262219225145083, -0.7726891396534619 ], [ -0.3027355672524316, -0.16586611797126483, 1.5533088536669204 ], [ -0.6798809793542048, -0.2139059353255716, -0.9893888380199064 ], [ -0.21245480348288004, 2.1060695008928962, 0.51752287748175 ], [ 0.4543253658230422, -1.6683853571439804, 1.3926813627854575 ], [ 0.01940927406179785, 0.7007601543275312, -0.07475720117809354 ], [ 0.07534058497523513, -0.2025174814205077, 0.30783818287079745 ], [ 1.9022962916340282, -1.2674942447474475, -2.3237223080015195 ], [ -1.4409890893141237, 0.41246931387422353, -0.7226487452495478 ], [ 1.6042666184490635, -1.515240554075744, 0.062181153725653235 ], [ 0.6099749396941666, -0.45814037189707796, -1.246859067669003 ], [ -1.4029994655457436, -0.4150774431109818, 0.41770022764806486 ], [ -0.8781299117222027, -0.01657385911473855, 1.4152548961647615 ], [ 0.6657039046189082, -0.6660718297902214, -0.7545528198356694 ], [ -0.8824984767716662, 0.4640989084765211, 1.074163579746361 ], [ -1.7964423429403393, 1.046328536439906, -0.8330057278009438 ], [ -1.6559553484737242, 0.4266998676001792, 0.459651924714793 ], [ 0.6686969283220927, -0.7324402856402679, 0.2711922187427269 ], [ -1.2054218487768364, 0.5484378478512105, 1.9882208316596526 ], [ -1.5551659630396637, 0.6356718518163866, 0.3622065188601168 ], [ -1.7034763167744251, 0.0003036475383094882, 0.6082561557876476 ], [ 0.8855074413278355, -0.15578275712670808, 0.23526282166738163 ], [ 1.0924971033422088, 0.35489815198759583, 1.4613471012390562 ], [ -0.0333076409803903, -1.7612953332139154, -1.0422103970486245 ], [ 0.38925531815967057, -0.7605756340481162, -1.2298609761764399 ], [ 0.7643009085464788, -0.007736713018857584, 0.29498728425963333 ], [ -2.2134925951634705, -0.040304904109173305, -1.3869148877734292 ], [ 1.5479758670118693, 0.8659647268999219, 1.3021648286580483 ], [ -0.788509407798865, -0.23554641458419398, 0.7806449108455962 ], [ -0.22967992357521205, -0.39152149038884915, -0.9393777542166419 ], [ 0.32468380781787565, 0.11006696187128313, -0.44608317349824356 ], [ 0.6943570736382344, 0.011127229604536857, -0.3057728139671225 ], [ 0.8742917657002856, 1.6637185438773794, 1.0058462260636423 ], [ 2.720908714742251, -2.7501424393428664, 1.4786910063971792 ], [ 0.4142678020456671, -0.6764272135776498, 0.2334216531476236 ], [ -0.6460020387716775, -0.6536145674035719, 1.6932859979485502 ], [ -0.026034498250755416, -0.7178369216428907, -0.49200799961619646 ], [ 1.1822577325054942, 2.180343591381334, 0.24305481345062238 ], [ -0.7877504175083573, -0.020849864372676816, 1.9264641674223557 ], [ 2.7573006536646907, -4.535547798475406, -1.969389542073824 ], [ 0.1897331744371354, 0.44788911787511554, -0.8213493647215204 ], [ -1.0627237037348942, -0.4560737174407429, -0.18827458638901537 ], [ -0.6643473894519981, -0.651427328107722, 0.05732150756004135 ], [ -0.411783342974808, -0.5900763842899446, 0.11572056535975675 ], [ -0.05241840971451897, -0.43114376603552307, -0.568154368998766 ], [ 1.3610500824738037, -0.29358551763908863, -0.6886440776168654 ], [ 1.2447998694180964, 1.0714286950173193, -0.44642641605848327 ], [ -1.5677672073242412, -0.0958927153518388, 0.36981339106030686 ], [ -0.2515615725128643, -0.43985724196550496, 0.9245411909667277 ], [ -1.5608439920286787, -0.8888827883921259, -0.9675969206579272 ], [ 1.0043112761875137, 1.9766194902340801, 1.5733110246155446 ], [ -0.14993246408124314, -0.34621887175837196, -0.5036921306330774 ], [ 0.038327209896915404, 0.09233970490992617, 0.8768962953895956 ], [ 0.17585743324536024, -0.17811332105325817, -1.1133114864614675 ], [ 0.47523308006542236, -0.37822887588368354, 0.8659220465516074 ], [ -0.15729096750750693, 0.25098435936849106, -1.1021348916347837 ], [ 0.4656587980742549, -0.3578772917220514, -0.7168557878527222 ], [ 0.12191692918131364, 0.8703253215228931, 0.21534472586272646 ], [ -0.7841894366399522, -0.7472948466274233, -2.2697432373576705 ], [ -0.49194629308851295, -0.8438390800673878, -1.1965098835161394 ], [ -2.575163552785401, 0.8105679487825435, 0.982801923300219 ], [ 0.5843237932466453, 2.0124707257076935, -0.26200026011266553 ], [ 0.5180764364571778, -0.4546182147190071, -0.17061494949757833 ], [ -1.9363199854460795, 3.9642831633708573, 4.292050240688654 ], [ -0.8108872800633058, -0.3502866174853782, 1.2644965930546868 ], [ 1.0659321860639068, 0.8520128809906704, -0.4841550726368682 ], [ 0.7224075755705179, -1.7438105314842482, -1.1700622086404362 ], [ 0.07496674626168559, 1.0845444174764587, 0.8583007761616245 ], [ -1.6624041948377195, -0.77991291716095, -1.2809640084091711 ], [ 1.0922279086151894, -0.22739318250347237, -1.5339612861328062 ], [ -0.8380492079969463, 1.5092375373742624, -0.10841219848723585 ], [ 0.13979125336698306, -1.154294133933032, 0.7681300556997753 ], [ 0.33594653467278435, -0.8535840834518128, 2.0543625160204617 ], [ 0.8908836225522652, 0.7630397813869461, -0.13325550364316666 ], [ -0.6139758366828489, 0.5774180614672596, 0.6908207753809028 ], [ 1.1278662565682938, 1.319177832561468, 0.054204813690957844 ], [ -0.9868850956591463, 0.46652423212501676, -2.1608240169013015 ], [ 0.7899854793631621, 0.3917559751940466, 0.5846613793751807 ], [ -2.033827354938971, 1.3500179837661122, -2.435531193727203 ], [ -0.7100644702600831, -2.757497343221682, -0.1166469346066061 ], [ 1.7999660427816022, 1.7545011874054237, 0.854835183300597 ], [ -0.4477482213035714, 0.7997245692053508, 0.7965564532298645 ], [ 0.1532180795698604, 0.8970105665301781, -1.5708440490608624 ], [ 0.38089074122163286, 0.801757799292524, 0.17364319734364872 ], [ 0.3179598531846244, 0.6351288343727712, 0.6571421239028151 ], [ -1.4164016091375475, -0.09905774600094108, 0.4874597143048545 ], [ -1.220723782089698, 0.8522075136634056, -0.7095348225641326 ], [ -0.5907952653374581, -0.8380600066392908, -1.0387538030562176 ], [ -0.2507110508729593, 0.8179588481358412, 0.4804935615504453 ], [ 2.6253934376514096, -1.9489592820893955, 1.67349105808873 ], [ 0.195769101286715, 0.904545447781404, -1.2608466519422048 ], [ 0.7394897422070499, 0.8383417997823791, -0.8495001397612897 ], [ -0.05399064061778951, 0.4779612799206315, -1.0284616684596648 ], [ 0.024072744891482433, 0.23857851908824457, -0.08189664643108072 ], [ -0.7820309937236879, -1.5735689064791554, 1.1179636444277434 ], [ 1.7845628079191271, 0.22297705200558604, 0.5161704760833521 ], [ -1.192684593020823, -0.47427894288111544, -0.5258362894239167 ], [ -0.3253620654013308, 1.1721247493282587, 0.7820237946287916 ], [ -0.2019081294596326, -0.6308065492190703, 0.9565401393391626 ], [ 0.23990392388078094, 0.14734593212917416, -0.21295256947286068 ], [ 0.46609048665750785, -0.09978254059069082, 0.10542097455777556 ], [ -0.236935839899202, -1.523296598375364, -0.0348459332934349 ], [ 0.3924064648400441, -1.804281128840407, -0.2926092689490284 ], [ -1.2654872399345398, -0.02181737130464854, 1.0234377286640954 ], [ 0.04334626459237646, -0.46772673808325, -0.7352332773495447 ], [ -0.5401905133157714, -0.1318064286847312, 0.20290340432906193 ], [ 0.6553636903528687, 0.12481199377180036, -0.12613174213263234 ], [ 0.42678831362319225, 0.04960870582066114, 0.22757547387067087 ], [ -0.35716201022198624, -0.8131436820922677, -0.23077238622574298 ], [ 0.03339685833499944, 0.028998468463822126, -0.3408784288978924 ], [ 0.7533914515625585, 1.0053654293687744, 1.0976711956884748 ], [ -0.5502275942645656, -1.5534332951644159, 0.17085354807128805 ], [ 0.06516646411287716, -0.003119779195467679, 0.9716613239480173 ], [ -0.4747803084185443, 0.33965509698656593, -0.45004216147020754 ], [ 1.0833966760615446, -0.7893542730070657, 0.32982781823189594 ], [ -1.0526938218809962, -0.1973783561065957, -0.9217057760196682 ], [ 0.7847316827519715, -0.09445880991479222, -0.09831932455299455 ], [ 0.39448957437042803, -0.40221446030481295, -0.217802188327724 ], [ 1.1507274966329226, 0.13683293958562068, 0.3768345654685672 ], [ -0.7786240220639598, -0.7300314170658212, -0.9453275490379967 ], [ 2.181220338295504, 1.8243084966211682, 1.3931554746064927 ], [ 0.5641802115054132, 1.4917547925288512, 0.6924462281643005 ], [ 1.582765493098793, -0.19282492858461345, -1.5746911939514 ], [ -1.1887394890175877, 0.2920891343427624, -0.7484431022634014 ], [ -0.05478459794065124, 1.0872638755735795, 0.9707982038920436 ], [ -0.30353338123327356, 0.05017460610162573, 0.4896598091273052 ], [ -0.11901929348550673, -0.0573762721033605, 0.6074125761321071 ], [ -0.2815375752194067, 0.21255276259557768, 1.217013934223256 ], [ 0.46392767286219927, -1.401026399323062, -0.5802254513663292 ], [ -1.2168054175817922, 0.08871418929798536, -1.7305572548904808 ], [ -0.2026372949284266, 1.7401096824864268, -1.2451978765216554 ], [ 1.047877884505827, 0.30838788518824517, -0.3192778017717324 ], [ 0.5378068415734623, -0.4551627748258144, 0.7497330258025198 ], [ 0.3615740269513603, -1.0917980198056605, 0.769599956611304 ], [ 1.4524845012005057, 0.012717201134516427, 0.6984875543350524 ], [ -0.6544473484167679, 0.5731148024929278, 0.23156377244328458 ], [ -0.10252925240420503, -0.823459727968298, -0.6200462163437187 ], [ -0.2184812172427751, 0.8322891607482186, -1.5361850351242023 ], [ 1.5542308520347257, 0.5387982597849112, 0.3579719083978328 ], [ -1.0063308794164902, 0.6864082444304647, 0.27293002882861495 ], [ 0.0015904857510436016, 0.384019005064657, 0.547249997193302 ], [ 0.8757783787963952, 0.36300356150936264, 0.29699300351988084 ], [ -0.4741961532898066, 1.2318281288568853, -0.16647726970586402 ], [ 0.19182476861507586, 0.4791565867839683, 0.8192536567750678 ], [ -0.15434088126316906, 0.16838991495352218, -1.624170573174458 ], [ 1.7295606944683914, -0.7934508151136576, 0.3842583749699628 ], [ -1.8218716029987319, -0.7336823866204314, 0.10642550540635744 ], [ 1.4040834435487182, -0.6095401657845295, 1.019001029323648 ], [ 0.008576950237481977, -0.07854932441477992, -0.21761681163414132 ], [ -0.06497183144014197, -0.29892390361531207, 0.1499563753607205 ], [ -2.4543288018333373, 2.6325292833569485, -2.840412147359541 ], [ 0.9417308298056417, -0.9619222341058286, 0.9371743169572752 ], [ 2.5691034575458116, 2.8194023602359515, -2.224941470043558 ], [ 0.6874641973854495, 0.9215913618329218, -0.9062935422885726 ], [ -1.0340918748897248, -0.7929566486711251, -1.1091372969742073 ], [ 0.19022554110594378, -0.2693813892657466, -0.24499934040425034 ], [ -2.651888163754472, -3.0158887999069877, 1.3122885558561315 ], [ -0.26656705738231257, 0.3162914629423803, 0.1588495715525807 ], [ 0.31360594343548565, 0.3841763567102501, 0.005481596542555704 ] ]
[ [ 5.835968755044973, -8.314534249900992, 2.101920738284761 ], [ -8.314534249900992, -1.4174802666660238, 12.506225895613378 ], [ 2.1019207382847616, 12.506225895613378, -0.4940931215235854 ] ]
true
null
null
null
null
null
6.155207
1.546337
null
CO_2312798568683522160860968
2312798568683522160860968265028807501051301540873998583356681518398531392519275592528448180649913600535594915934612336891945445500002266203738826244466522
2872237201146594164245459344454172020963978676483439215962754586115973433075263796322491153957124400078885207581254205341055291967822031775468274428696995
[ [ 16.3999889955, 0, 0 ], [ 0, 16.3999889955, 0 ], [ 0, 0, 16.3999889955 ] ]
[ [ 1.263979951861176, 1.0285581098307734, 1.051993694105343 ], [ 2.7260881707769875, 2.648877022586173, -0.1962914682871395 ], [ 4.0161441051410085, 3.990199322550127, 1.210843987515756 ], [ 2.688368196087337, 0.023615984153520002, 2.611337447775474 ], [ 4.112330040599615, 1.3371075027921107, 4.139488422376164 ], [ 0.061827958513035, 2.674756205221072, 2.5537734864012687 ], [ 1.286119937005101, 4.19004958844929, 3.9637789402783765 ], [ -0.17787428064519298, 0.16278629076933301, 5.53926028312008 ], [ 1.26312715243341, 1.5232801778690264, 6.797090239107944 ], [ 2.5236959065835216, 2.585245065283633, 5.24620887975949 ], [ 3.992708520866439, 4.271278733944002, 6.6630531290477215 ], [ 2.2945388603494004, -0.128805513570657, 8.035076208411251 ], [ 4.147934416708846, 1.0123221207252284, 9.19842582779604 ], [ 0.0319963785302205, 2.811761713289479, 8.363584387980112 ], [ 1.5214597790905258, 4.170140001808753, 9.4726336438008 ], [ -0.07593194904916499, -0.059761559899601996, 10.85700591487794 ], [ 1.236952769996592, 1.3483578952430235, 12.452577244239132 ], [ 2.930776433429823, 2.6306402348231774, 10.899662286255237 ], [ 4.239331555380768, 4.234214758814172, 12.097550282464548 ], [ 2.6290002359236273, -0.195455068848369, 13.60525047078785 ], [ 4.110230842008192, 1.1766172104821475, 14.911279994433485 ], [ -0.1634258903401575, 2.868144875456008, 13.943057444117159 ], [ 1.4468234291720052, 4.21512517162341, 15.103061465746865 ], [ -0.07507914962139899, 5.537718684154503, -0.133758310247298 ], [ 1.351162293361254, 6.930405749652363, 1.3074563226882465 ], [ 2.787473329587144, 8.271974049451249, 0.136021508728677 ], [ 4.234329558737141, 9.686243500467187, 1.4564994226793504 ], [ 2.6540922190867424, 5.547657077485776, 2.4305931690560687 ], [ 3.9719789347761267, 6.888405377834887, 3.720009503849265 ], [ -0.0012135991856669999, 8.343051601757747, 2.8363616967827294 ], [ 1.6215489119300626, 9.567851979908673, 4.064196072897824 ], [ -0.15944069301425098, 5.298229644853216, 5.467559531231754 ], [ 1.2269979766763233, 6.720846690267864, 6.690359110725229 ], [ 2.809990514477965, 7.925163482163411, 5.424378360206602 ], [ 3.9073629781338566, 9.51858641296619, 6.697739105773205 ], [ 2.7487201555907776, 5.7164785642054525, 8.011558624191705 ], [ 4.305407111043637, 6.971799321877005, 9.227814608075974 ], [ -0.0436075707390345, 8.149203731830935, 8.210588890641093 ], [ 1.4248146439400444, 9.689572698233274, 9.364869316111369 ], [ -0.09887553365386949, 5.158796938413475, 10.866321108627385 ], [ 1.493842197622104, 6.636107947128115, 12.132301859146011 ], [ 2.91052244702038, 8.183430508864545, 10.717753608317151 ], [ 4.2655059378175855, 9.500677624983105, 12.185126223700518 ], [ 2.995818789785976, 5.661981400773406, 13.522807726107471 ], [ 4.173731599398768, 6.830136216933876, 15.324510517153099 ], [ 0.11939191988723999, 7.907107094279365, 13.694040011209486 ], [ 1.368218281916574, 9.46399084960017, 15.044480705054939 ], [ 0.1564722950060655, 11.301347216722018, -0.163606290219108 ], [ 1.539466967007585, 12.374414896686579, 1.2797075413078605 ], [ 2.8112041136636328, 13.864681896707664, -0.1516178982633975 ], [ 4.227244763491084, 15.150342634020891, 1.3513098932622134 ], [ 2.8324256994238093, 10.932577064169205, 2.592247860584712 ], [ 3.9023445815012336, 12.21904140094321, 4.120316835240424 ], [ 0.377626146610383, 13.550244907696943, 2.91478644415921 ], [ 1.3255947105172694, 15.215220990487088, 4.12280963356774 ], [ -0.08172114516457649, 10.70889761425958, 5.339557617121876 ], [ 1.4029862585870339, 12.29456335026749, 6.878598184415578 ], [ 2.7914913268910415, 13.803050738062575, 5.478629523803717 ], [ 3.98978932282524, 15.224175384478631, 6.791579842805455 ], [ 2.8256689039576637, 10.90784588076399, 8.152204929817112 ], [ 4.178700796064405, 12.291381752402362, 9.488066033445564 ], [ -0.028421180929201498, 13.738943181079165, 8.120126551341915 ], [ 1.315443117329055, 14.88200601407652, 9.5943543621254 ], [ 0.009987593298259498, 10.869371506580547, 10.92373747010063 ], [ 1.244595164868495, 12.193965817769092, 12.372250098139173 ], [ 2.8319336997539444, 13.336635051030555, 11.111894543846002 ], [ 4.020244102389883, 14.957905163147693, 12.25887697421328 ], [ 2.936811629380167, 10.879916699504655, 13.648841641537887 ], [ 4.125335231873048, 12.336153722360077, 14.911689994158374 ], [ -0.0312419790364275, 13.581618086645333, 13.84621550909873 ], [ -0.0057235961594295, 15.779331411965302, 16.177654344688005 ], [ 5.55041227563702, 0.15183109812033901, -0.134971909432965 ], [ 6.852292602066796, 1.2284411757079274, 1.513489384438713 ], [ 8.146645333547639, 2.755099751310027, 0.096464735271531 ], [ 9.459644852516364, 4.105458445210502, 1.643475697217046 ], [ 8.406060359478458, -0.24273623712239548, 2.8517448864605086 ], [ 9.506450421109522, 1.449168627598362, 3.9244681666561636 ], [ 5.353399207834078, 2.783602932184206, 2.861060080209952 ], [ 6.853899800988355, 4.065065272314585, 4.157610410216191 ], [ 5.621522627921508, 0.0153667896887835, 5.3332764213366 ], [ 7.017965290899337, 1.3469146962114193, 6.721748689662616 ], [ 8.362255988871476, 2.729253368653119, 5.320172830129195 ], [ 9.705070687834022, 4.168073603195321, 6.6286623521241586 ], [ 8.423477147791678, -0.0942507367571385, 8.101086164118138 ], [ 9.42882927319382, 1.4566142226023189, 9.495052428757647 ], [ 5.483319920656429, 2.65581421793127, 7.714259623681281 ], [ 6.825462220070158, 3.9558249456155594, 9.259614186738249 ], [ 5.488239917355079, -0.0416723720375655, 10.828683133882713 ], [ 6.683799115127029, 1.3744666777238594, 12.19401501773608 ], [ 7.965769854916268, 2.71813417611417, 10.738138794638557 ], [ 9.512206817246941, 4.241463553950183, 12.172235832350054 ], [ 7.990943838024361, 0.07934314676022901, 13.766363962679641 ], [ 9.404770489337421, 1.341945499545783, 15.0745090849057 ], [ 5.558103870475909, 2.674346205496185, 13.69012041383956 ], [ 6.850652603167246, 4.018079303842478, 14.859505229174694 ], [ 5.611338234755302, 5.361681202276806, -0.07594834903816049 ], [ 6.748185471923362, 6.862624595133962, 1.4044786575856245 ], [ 8.11423895529253, 8.15520612780329, 0.019581586860627 ], [ 9.447722060516634, 9.511682017599085, 1.415056650487722 ], [ 7.862777924024528, 5.256639272760628, 2.5910998613550267 ], [ 9.414233282987823, 6.791284643003536, 3.833038228006251 ], [ 5.476071125520418, 8.32302721519424, 2.706752583751293 ], [ 6.816327426199665, 9.744315861500253, 3.944886152955561 ], [ 5.269086864408213, 5.529633489579721, 5.186381719903906 ], [ 6.664086328354438, 6.578461985808932, 6.611950763337744 ], [ 8.100315364635351, 8.09291896959838, 5.098592578810995 ], [ 9.590828364491367, 8.799299295612556, 6.8595905971697935 ], [ 8.1595357248981, 5.368191997908019, 8.029926611866665 ], [ 8.469528316891042, 8.054313395502973, 10.654859650519409 ], [ 5.689254582472922, 8.371767982488866, 7.881145911699488 ], [ 7.116086425059414, 9.541628397504867, 9.37438130972876 ], [ 5.5724374608579765, 5.530027089315614, 10.688348428048219 ], [ 6.757435065716824, 6.825445820081162, 12.2445925837982 ], [ 9.292758564498156, 9.349371326510623, 12.324378530261308 ], [ 8.269448451145943, 5.493766713646563, 13.573565692048543 ], [ 9.493281229946135, 6.7353114805618945, 15.08065908077901 ], [ 5.517907497447938, 8.14379173546242, 13.710505600160968 ], [ 6.834679013885629, 9.438406866767192, 14.872756420283057 ], [ 5.510297902554027, 10.924557469550404, -0.0929059376595075 ], [ 6.825544220015136, 12.2311117928439, 1.2897443345731066 ], [ 8.13734653978719, 13.664290431171649, 0.076456748697021 ], [ 9.649835524897176, 14.769108489831497, 1.4335394380856505 ], [ 8.265086054073139, 10.994864222374114, 2.772090139909365 ], [ 9.61272234980036, 12.148423048328588, 4.2569943435289215 ], [ 5.477809524353941, 13.535812917380902, 2.779388135012362 ], [ 7.065984458678161, 14.919922788634116, 4.400740247074479 ], [ 5.374948793374165, 10.95453664943418, 5.495882312226982 ], [ 6.851882602341909, 12.174941830534312, 6.744249474564443 ], [ 8.27051445043065, 13.358561836317538, 5.59141224812577 ], [ 9.627236340061378, 14.763007693925172, 6.9152849597985115 ], [ 8.274565247712538, 11.047754186884601, 7.991386637727239 ], [ 9.569081979083336, 12.229717793779283, 9.594747961861293 ], [ 5.380819989434554, 13.722838391885585, 8.176837713288354 ], [ 6.862427795266015, 15.18204381274919, 9.55842198623626 ], [ 5.619325029396111, 10.77628516904209, 10.70146841924462 ], [ 6.841189809516843, 12.287576954955405, 12.312685338107517 ], [ 8.012936223267326, 13.709488800843248, 11.030927798175219 ], [ 9.378661706856585, 14.903227599836697, 12.447083247925638 ], [ 8.161520123566556, 10.987713827172076, 13.563938898508184 ], [ 9.43276527055274, 12.470814032002128, 14.806910464466124 ], [ 5.394497580256801, 13.601035673616005, 13.576845689847643 ], [ 6.797680638711781, 14.920693588116904, 14.978159149557136 ], [ 10.775137169812405, -0.2675986204395735, -0.051692765313815996 ], [ 12.289561353623862, 1.155969624336813, 1.405610256826314 ], [ 13.50178294021524, 2.5470002909461273, -0.1655250889315815 ], [ 15.198837401480583, 3.886534992109572, 1.3065379233044985 ], [ 13.687299615732336, -0.011119192538949, 2.713935778931322 ], [ 14.978093549601153, 1.2598635546233055, 3.9171537715641707 ], [ 11.09218175707341, 2.6408410279783783, 2.7007993877459264 ], [ 12.492806417245093, 3.9335865605376616, 4.217585169972735 ], [ 10.723575604410554, -0.20823066027586348, 5.363993600725172 ], [ 12.111113073363827, 1.2570919564830658, 6.688456712001751 ], [ 13.891184278924392, 2.569107476112061, 5.4943899132283915 ], [ 15.07716588312297, 3.9750457327182858, 6.992463308011335 ], [ 13.402595806770455, 0.108502327194228, 8.39551516655435 ], [ 15.017469923179348, 1.296747129874185, 9.54435079567812 ], [ 10.662223245578389, 2.8454308906972408, 8.031189411019318 ], [ 12.214416604046482, 3.936030158897991, 9.59712596026564 ], [ 10.542322926032286, -0.11734192126280249, 11.028943399506764 ], [ 12.150817446721932, 1.1079996565249755, 12.298023747945539 ], [ 13.588899681759335, 2.56299028021674, 11.00126021808236 ], [ 14.921316787698734, 4.146704417534184, 12.292742951488988 ], [ 13.62660325645999, -0.164196689822946, 13.475641357756412 ], [ 15.118887455127522, 1.1739276122868856, 15.088219475705936 ], [ 10.767461974962512, 2.529435902731947, 13.465014164887329 ], [ 12.137205455855666, 4.029624896095309, 14.79013327572373 ], [ 10.862237511367507, 5.340968016175489, 0.0389827738423035 ], [ 12.432257657873707, 6.810882629853158, 1.1799464082482338 ], [ 13.717836395241957, 8.596152631925296, -0.0322259783761575 ], [ 15.223470184951825, 9.981935302056051, 1.3761066766234094 ], [ 13.930675452425556, 5.414259566996378, 2.51477431256997 ], [ 15.03142631381452, 6.844207407492014, 4.096553251185945 ], [ 11.042850590174947, 8.120831750868721, 2.549509489262439 ], [ 12.145471050309398, 9.566015181141177, 4.017964503919509 ], [ 11.172754903008304, 5.462508334621139, 5.453799940464529 ], [ 12.186274222930203, 7.130190415595544, 6.929274150411673 ], [ 13.48311975273836, 8.107777359628303, 5.286995652391298 ], [ 14.956642363995039, 9.236605002177564, 6.594697974914477 ], [ 13.623634858451803, 5.617242230793683, 8.12521054793052 ], [ 15.000495934569006, 6.79633583961415, 9.546203994434613 ], [ 10.434640598287835, 7.67388285077436, 9.02261794576428 ], [ 12.08518469076194, 9.567556780106754, 9.300810959094948 ], [ 10.94943625285658, 5.571929061199116, 10.815563142686313 ], [ 12.163527438193444, 6.961910128512718, 12.21667980252786 ], [ 13.497240143263486, 8.290473237038173, 10.780450766246947 ], [ 14.910492794961703, 9.405344488952263, 12.25577737629313 ], [ 13.49128694725812, 5.537899084033453, 13.573155692323656 ], [ 14.699014936864732, 6.763732661491096, 14.955674764644305 ], [ 10.669144040934489, 7.980054245331349, 13.611121666848238 ], [ 11.848401649644911, 9.465811248378673, 15.177140216039538 ], [ 10.703354417979101, 10.980793031815974, 0.021647985474059998 ], [ 12.28952855364587, 12.10584867689627, 1.2011187940414245 ], [ 13.66435603112763, 13.611416866650156, 0.026600782150700997 ], [ 15.107079463050761, 14.803171266975152, 1.480197406777848 ], [ 13.683084818560493, 11.024351402588023, 2.6798238018206817 ], [ 15.040479107740035, 12.465090435842699, 4.174649998782516 ], [ 11.197912486127398, 13.358857036119456, 2.9586072147551863 ], [ 12.30607614254233, 14.91665919082401, 4.185801991299456 ], [ 10.684100830898384, 10.59173609287573, 5.639415015915598 ], [ 12.23690098895931, 12.129071061313898, 6.690178710846279 ], [ 13.600494473979154, 13.721181992997039, 5.509035103401374 ], [ 14.711757728314234, 15.17490981753615, 6.8951949732790245 ], [ 13.790865546238917, 10.768462374291238, 7.990615838244452 ], [ 15.003316732676232, 12.333792123944725, 9.547975193246126 ], [ 11.046458587753957, 13.357266237186893, 8.326766412685215 ], [ 11.922234400102653, 14.9914103406655, 9.6333535359567 ], [ 10.86910910675662, 10.648201254987235, 10.93193746459838 ], [ 12.131235859861304, 12.125807463503794, 12.220812599754725 ], [ 13.386081017851987, 13.508457735736407, 10.826452735379325 ], [ 15.03518191129449, 14.685616145855406, 12.202034612354877 ], [ 13.421078594368383, 10.684871630381174, 13.616123663491866 ], [ 14.841629241169597, 12.180550626770772, 15.087268276344197 ], [ 10.902187884560544, 13.752194372187528, 13.61377846506551 ], [ 12.487410820865573, 15.070031887909927, 15.037789509544773 ], [ 1.8519785973102347, 14.816901337762184, -1.0608874081376027 ], [ 7.370602774277277, 4.366315030174025, 7.085605405512377 ], [ 12.028678528677945, 4.6369656885656605, 6.523723742538652 ], [ 8.695651365160996, 7.5771967156513895, 3.012148258828795 ], [ 11.75875930979551, 4.767739200815777, 11.76021562881831 ], [ 9.176592522446331, 10.293917212714147, 7.146027884968498 ], [ 3.4410292910468145, 0.676138746306474, 12.717181226688126 ], [ 0.8507969891096494, 14.567880624856713, 14.761695694805532 ], [ -0.9037771535596122, 16.822127992241967, 17.208726572831786 ], [ 8.620783775397639, 9.657597639688747, 7.528306708456904 ], [ 9.85938474428828, 9.156743615765077, 9.143735144493846 ], [ 13.235415958949227, 6.15673462879075, 6.023125558443311 ] ]
[ true, true, true ]
H12Si214
H6Si107
A107B6
[ "H", "Si" ]
[ 0.05309734513274336, 0.9469026548672567 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
226
2
3
[ 1, 1, 1 ]
[ "training_structures_divacancy_58" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/0177/MD_6975474728105545870780177.json
null
{"energy-sigma": 0.113, "force-atom-sigma": [0.1, 0.1, 0.1, 0.1, 0.1, 0.127, 0.1, 0.1, 0.1, 0.117, 0.1, 0.101, 0.101, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.116, 0.1, 0.119, 0.103, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.124, 0.133, 0.1, 0.1, 0.1, 0.1, 0.106, 0.1, 0.1, 0.126, 0.1, 0.1, 0.1, 0.1, 0.106, 0.114, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.101, 0.1, 0.109, 0.1, 0.1, 0.109, 0.111, 0.1, 0.1, 0.163, 0.1, 0.11, 0.1, 0.1, 0.1, 0.1, 0.1, 0.112, 0.1, 0.1, 0.119, 0.1, 0.1, 0.1, 0.1, 0.102, 0.1, 0.1, 0.131, 0.11, 0.1, 0.1, 0.1, 0.1, 0.107, 0.207, 0.1, 0.1, 0.1, 0.125, 0.104, 0.283, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.102, 0.136, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.126, 0.1, 0.144, 0.106, 0.1, 0.308, 0.1, 0.1, 0.111, 0.1, 0.112, 0.1, 0.1, 0.1, 0.112, 0.1, 0.1, 0.1, 0.121, 0.1, 0.172, 0.142, 0.133, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.184, 0.1, 0.1, 0.1, 0.1, 0.104, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.158, 0.1, 0.112, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.106, 0.107, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.229, 0.1, 0.221, 0.1, 0.1, 0.1, 0.211, 0.1, 0.1], "virial-sigma-alternate": 5.65, "virial-sigma-paper": 5.65, "hash": "6975474728105545870780177238263715730003265407698801056086159894638901652766040742936331389859071712468107080389942602204969607571440607541615972334733072", "id": "MD_6975474728105545870780177"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_4921110044302656655635827
4921110044302656655635827782898676762074171532823223792619147537294810962047264404728620171988919293305397495059217593365891445762101531026164921774135086
2025-04-16T18:11:19
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-13,752.029099
[ [ -0.0201533519414487, 0.3431150334158892, 0.11308081152756072 ], [ 0.06879017995109386, -0.5309090802205689, 0.6454127414322997 ], [ 0.14183425365437272, 0.4020727924016728, -0.19541865963157887 ], [ -0.02731259470540103, -0.06399326875529358, -0.1921939793390491 ], [ 0.24323684770728887, 0.16599287346354813, -0.024770542875370623 ], [ -0.060515591699261295, 0.45633159930435374, -0.07237044410940006 ], [ 0.14065051676497656, 0.4501306074932206, 0.009494577726242825 ], [ -0.08113765614057301, -0.270916853362939, 0.2067837164782294 ], [ 0.6051572025452732, -0.16951657330481107, 0.25224291542270355 ], [ -0.2165084081306255, -0.1147507444329969, 0.31609297361166494 ], [ 0.9544187203395085, 0.24661476587689937, 0.663650619910238 ], [ -0.2925722450324183, 0.12267900479820552, 0.03655417566814128 ], [ -0.41166378657742114, -0.4657433874392877, 0.6780051009126247 ], [ 0.7989169850242924, -0.35785877976374636, 0.12425252125413615 ], [ -0.3262611809317865, -0.18782567140011755, 0.11536086772546802 ], [ -0.38399612222730767, 1.1199248835659523, -0.0799847725150186 ], [ -0.2993069983080141, 0.1666873290105201, 0.4934102804578052 ], [ -0.09141950631584517, -0.8340475396766677, 0.36448657505802406 ], [ 1.2214634890903044, 0.5731232871404842, 0.16446255157699596 ], [ -0.7696138405800327, -0.10029881853897656, 0.5684865558061291 ], [ 0.08335780558452087, 0.6622645370321462, 0.5604734489653557 ], [ -0.47825541436925634, -1.2045515296259663, 0.7999569971262924 ], [ 1.0089675479223021, -0.3587175289406758, -0.2918137689629746 ], [ 0.14078858512066852, -0.06657414427565823, -0.17744869032799987 ], [ -0.3350006250255019, 0.47622989759804374, 0.25102909660106165 ], [ -0.5042030092601908, 0.08693344175325081, 0.4849215191328044 ], [ -0.24261901109885725, 0.16580723965943342, -0.08479248235316349 ], [ 0.5758900535754956, 0.474619871446567, 0.17572604976350067 ], [ -0.11797053962541834, 0.8019215787014174, -0.15932239782095592 ], [ 0.3923889813238671, 0.40427237300305946, -0.34639190714641793 ], [ 0.12474411659134847, 1.7094559364174935, -0.09791926056517952 ], [ -0.07647264264769632, -0.9530362370088646, 0.20970320656925753 ], [ 0.5125454746924752, -0.12103426872490679, 0.05247960202113849 ], [ -0.06429768762519913, 0.5686534205414068, 0.04202445934728833 ], [ 0.16410105416898316, 0.04584152230558017, 0.9469038937097796 ], [ -0.42574984418438444, 0.1289972390119374, -0.3142250655965773 ], [ 0.003883140365019643, -0.10464501497215487, -0.7044268076245944 ], [ 0.43691075526861517, 0.08622638779021008, -0.6832738099346721 ], [ -1.1033890768099521, -0.3096947780224764, 0.057107077376341 ], [ -0.2031787697088498, 0.49367279031099237, 0.14498025812410592 ], [ -1.2389886571734976, 0.09904154803742415, -0.14299613614854764 ], [ 0.9264474084510854, 0.22830078268148465, -0.06406140304627753 ], [ 0.2461941330465232, -0.30495468825425137, -0.07833103757309935 ], [ 0.5133551157577899, -1.0729430760508867, -0.11972891855386761 ], [ 0.613315833947167, -0.6035931991790271, 0.1669601232849878 ], [ -0.5114782088740818, -0.6659515020612384, -0.021133200178957135 ], [ 0.06080047016873372, 1.0852252461652339, 0.05359443328795469 ], [ -0.5801660588334339, 0.18122230160638123, -0.0662643260845804 ], [ -0.14070939507680796, -0.7807115024733879, -0.4163185156490173 ], [ -0.7361113098163752, 0.3871943201350399, -1.0521382060213125 ], [ -0.23188927437681534, -0.7001235486502626, -0.7750591845375744 ], [ -0.4878456372134088, -1.046106650050777, -0.7050083916480119 ], [ 0.6838587363950058, 0.3567097527961722, -0.4023898096876471 ], [ 0.3716105936790904, -0.34972277408866975, 0.27787246458553566 ], [ -0.18115853819444155, 0.6129815902555478, -0.47156257011037894 ], [ -0.43940035655011467, 0.7012846598128414, -0.8855408656969974 ], [ -0.331686984488895, -0.9668528427782767, -0.744685688948537 ], [ -0.523269554982813, -0.35604486496038185, 0.0499118391379066 ], [ 0.0785747783574494, -0.7006984477998477, -0.046125886553988554 ], [ -0.21840151297785051, 0.9740941038019416, -0.6552261362182408 ], [ -0.16261984039404584, -0.8837760590052477, -0.3950428762353239 ], [ -0.3505964356764561, -0.07324230592346229, -0.40599629912021873 ], [ -0.028535412395663453, -0.5931331714050687, -0.44166781433195323 ], [ 0.007316851520077402, 0.4998449857425398, 0.48534472306850074 ], [ -0.1598186211477445, -0.242440576389639, -0.011740181112860158 ], [ -0.4171443546778488, 0.16230050911328345, -0.4042893422981725 ], [ 0.211777060120489, 0.3150786725628665, 0.10034432710314319 ], [ 0.4420532230194434, -0.3664511566331492, -0.3166997544672198 ], [ 0.21568745420190216, -0.5786300805151773, 0.21910676716716715 ], [ 0.5048943794807786, -1.0283004601560914, 0.4835819732610072 ], [ 0.18897521258875574, -0.2145116877389985, -0.36056101145522196 ], [ -0.18393584616126551, 0.7961754154214186, -0.3498101916695548 ], [ 0.47029578651914206, -0.2767882294720292, 0.16235347388287852 ], [ -0.39827706961753817, 0.15116505197172214, 0.28357286219083594 ], [ 0.9266975769987358, 1.6717015687859074, 0.7960941684933018 ], [ 0.14203454275881225, 0.5523024762579251, -1.2627407852315575 ], [ 0.13579781258372908, 0.060785300647344845, -0.4919156969352032 ], [ 0.3049030090373165, -0.9284261311054713, 0.12096124933381458 ], [ -0.47878994716531525, 0.8869246345803012, 0.21554758607248617 ], [ 0.25963098656014905, 0.11767846206104951, 0.7315478549836444 ], [ 0.29611985615315856, 0.05240144041940599, -0.3939876946119351 ], [ -0.6166942663378416, 0.20398686811097233, -0.03823362166326201 ], [ 0.3046890930746801, -0.2597389729835953, 0.42469723366631584 ], [ 0.7539187852637209, -0.01789386458610257, 0.09044839983642525 ], [ -0.06948643527178996, 0.28518314545284473, -0.3207081076613307 ], [ -0.346792999576361, 0.4998084760469937, -0.5547416838751495 ], [ -0.6084279056230335, 0.20683333881090823, -0.6419792873877739 ], [ -0.7405356678512861, 0.675355062659148, 0.5909978684366857 ], [ -0.4019640346466305, 0.3344177554494243, 0.1866131381311357 ], [ 1.1671825706818704, -1.5956791266797687, -0.044078001166490605 ], [ 0.2388250880884468, -0.6363403391996251, 0.08525990930036642 ], [ 0.015086988908096914, -0.04305804368598786, -0.008201568860740357 ], [ -0.32955682373115236, -1.4418676360020182, -1.2984385257175577 ], [ -0.19406574401211696, -0.1399547756653445, 0.6780498381451953 ], [ 0.2300455347517371, -0.08310866547899852, -0.21727716862134974 ], [ -0.26650895040207717, 0.3667530043977346, -1.1453502869663648 ], [ 1.3767744483907651, 0.7828020682092003, -0.7600781251686676 ], [ 0.43023719429963886, -0.014901097993450206, -0.7418003945582669 ], [ 0.5616852109027415, -0.24505821871608177, 0.023118350596643467 ], [ 0.27543428541043924, -0.4114334155407359, -1.0173799474192946 ], [ -0.01929537409611529, 0.7052097091945795, -1.8642153936267827 ], [ 0.7541162461523082, -1.1901728802335703, -0.255236967568016 ], [ -0.462535419331339, -0.6070225394550406, -0.3946705801849665 ], [ -0.424127733837903, 0.588088662766938, -0.16911805198018812 ], [ -0.5493536755662471, -0.7205730919245923, 0.2987341560426851 ], [ -0.037037029247265096, -0.5307111051109176, -0.029873158493736496 ], [ -0.8465526246222719, -0.1287455278010949, -0.9638127678477333 ], [ -0.5887774618822058, -0.0463194907845957, -0.16381823258376688 ], [ -0.029166361641227795, -0.08987632890269229, 0.7453395210314507 ], [ 0.9866783787914062, 0.797016423971639, -1.010930586834235 ], [ 0.29063594561581474, 0.272270283203465, -0.056215418051313644 ], [ 0.4906190885222525, 0.47154354393100983, 0.9560112629748081 ], [ -1.252864141254741, -0.12924303668054357, 0.2648696136499508 ], [ 0.8256816771859699, 0.33221483241112143, 0.029095142023859693 ], [ -0.2996648961685788, 0.5132723261664811, 0.2814352452276649 ], [ 0.8620972702773552, 0.06221020721577091, 1.0818025907630529 ], [ 0.24056212684273878, 0.5155765507543978, 0.011550176429701216 ], [ -1.277886909562018, 0.10956405367066216, 0.7205589508453316 ], [ -0.023583206438526242, -0.7335306914065427, 1.7592034819254427 ], [ -1.489250021725963, 0.584771936903947, 0.18526896426976228 ], [ -0.12179737278392674, -0.26410393848561065, 1.0056796184388965 ], [ -0.7896805462721925, 0.14213995807693836, 0.16392493345455303 ], [ 0.7955606641393711, 0.5665104042570633, -0.5874890810062795 ], [ 1.670065574470697, 0.22951331595046648, 0.8772377381761112 ], [ -0.817939821956472, 0.5506243158154643, 0.7144078384774093 ], [ 0.25191947037342893, 0.3455735243230148, 1.5550286660155677 ], [ 0.4661311101215661, 0.4775401328691912, -0.23396364214911078 ], [ -0.16053621664259787, 0.075234141214981, 1.9611980005238323 ], [ 0.019440641546703656, -0.791495232407153, 0.06928948860426663 ], [ -0.5336313665335417, -0.7386433343356571, -0.5629684495680274 ], [ 0.47471140279596424, 0.3817764870044238, 0.19055258570266662 ], [ 0.2814059346270152, -0.15894727355474633, 0.6056685953934505 ], [ 0.20921521077949345, -0.3714288165329559, 0.18058363904485644 ], [ -0.9189798901592473, 0.1350046265924634, 0.06393798999091041 ], [ 0.036582972047726946, 0.27448169088932434, 1.0110601705423707 ], [ 0.34037063559716313, -0.6711785591770995, 0.00977508531667098 ], [ -0.7083336021585594, -0.2625869863467233, -0.2370965339817112 ], [ -0.05193195658794694, 0.08943229901390272, -0.07563317676066798 ], [ -0.0029387733809292543, 0.4310494064702737, -0.3718286234102389 ], [ 0.3988365421352024, -0.08597210547404743, 0.8547737338834454 ], [ -0.48249542415271257, -0.12455796856616973, 0.6754311673766245 ], [ -0.8987584039268146, 0.42926891603607115, -0.6047237141882962 ], [ 0.04399726845943796, -1.1529882695409288, -0.5275285909456382 ], [ 0.6826773135003978, 0.15563954656037585, -1.1727158464413607 ] ]
[ [ -5.1730998568520326, -1.291644100449814, -5.949391008132476 ], [ -1.291644100449814, 8.069513900284948, -9.582955472529175 ], [ -5.949391008132476, -9.582955472529175, -5.525366429701982 ] ]
true
null
null
null
null
null
2.070536
0.890832
null
CO_5111113577961447528727908
5111113577961447528727908320247483729633662058232282462212361464156758323248382537573020765956932057182608152684748501780873389735374779932461669970599608
2906357068066396880711065787133930990580508506837770123015082104128449563607765195910460258970886781359413286981726225043116521858416968239114726775380036
[ [ 11.5187545121, 0, 0 ], [ 0, 19.951070271437317, 0 ], [ 0, 0, 30.916256479194814 ] ]
[ [ 10.332138497281505, 15.801165963971354, 8.988221218970322 ], [ 4.780409828821133, 0.41679346139037515, 8.785008503743306 ], [ 6.967452710524535, 19.475933166567703, 8.89330783366607 ], [ 2.5177578425003055, 3.814843320591643, 8.79879645289429 ], [ 4.225643574009372, 2.4741317116611783, 8.071770679980428 ], [ 6.121008553957378, 3.433259236118404, 9.023898257320651 ], [ 3.524600655648454, 5.930075982915712, 8.892813679097502 ], [ 5.945958041636996, 5.84735865488887, 9.02912316436734 ], [ 1.5897493852329692, 7.347160389887754, 9.286902523469076 ], [ 4.298119577399506, 10.582325845284318, 9.003771537561658 ], [ 10.842096797041197, 13.383675423872525, 9.054937845104407 ], [ 2.1580386578419346, 9.651289107455751, 9.04186060310682 ], [ 8.52042271260037, 13.478662529205657, 8.811318490924394 ], [ 1.429822997586973, 13.542046779659387, 8.062155975589178 ], [ 3.5862951048152625, 12.842303176807436, 9.022166988517482 ], [ 8.202493569311898, 15.620888240853379, 8.198217807637006 ], [ 1.189069509529571, 15.803041217205925, 8.554527440959795 ], [ 6.512289125978904, 17.20145141936295, 8.760398684728205 ], [ 11.473105687968546, 19.926109130409596, 11.154677782609701 ], [ 3.913220395377684, 19.929002641543036, 10.955329609521494 ], [ 7.646944039193315, 19.87387733807448, 11.139961421845042 ], [ 1.9809838822364456, 3.495587216783377, 11.038989171667424 ], [ 5.735314577874223, 3.284265298379842, 11.36889666777303 ], [ 9.550026584664428, 3.329713696182784, 11.189211008636978 ], [ 3.8351462772946707, 6.503908080195901, 11.213665324466165 ], [ 7.539278240768716, 6.596101887559846, 10.860324074181143 ], [ 0.05718831240167408, 6.700706001035129, 11.163952683742844 ], [ 5.556727807918624, 9.955802357363979, 11.025231171278172 ], [ 9.679174860254093, 9.94726350464416, 11.136096879706232 ], [ 2.005426679311122, 9.985849028508792, 11.386951163595295 ], [ 7.860778197955939, 13.184244315751831, 11.15068883792216 ], [ 0.0438173421640284, 13.369869044714322, 11.377490810514507 ], [ 3.910064256641369, 13.29004522782092, 11.3489242993245 ], [ 9.752399582687513, 16.55763136966724, 11.204946779175955 ], [ 1.8543812513939546, 16.393952171801203, 10.850337314019153 ], [ 5.87412708849954, 16.62969384977039, 11.03629954248885 ], [ 1.939677628556055, 1.1756501605229743, 11.854559610515798 ], [ 5.714419557189274, 1.0028170084461698, 12.079876815651536 ], [ 9.665559692420791, 1.128767677783276, 11.893607036436368 ], [ 3.868953821787684, 4.364874215423479, 12.099786982825702 ], [ 7.756464357094361, 4.496092411198968, 11.969939518837151 ], [ 11.458511426001717, 4.425006721478446, 11.87131594270455 ], [ 5.713025787893309, 7.761244640216882, 11.90575701869573 ], [ 9.490820186472234, 7.804219961426077, 11.71287086688881 ], [ 1.8876704519339236, 7.795799751877731, 12.118182433781524 ], [ 7.684852260292635, 10.994894227519655, 11.69614448346179 ], [ 0.01399874235855513, 11.000539569106035, 12.038295263738306 ], [ 3.943215232127193, 11.082139577945203, 12.29452880598452 ], [ 9.653084881284187, 14.489921632833743, 12.224874897449851 ], [ 2.0547845423954705, 14.371991472263412, 12.219433437818335 ], [ 5.969237444505949, 14.483837426700452, 11.966538030629728 ], [ 0.19009285383773508, 17.78384310312108, 11.923688263844717 ], [ 3.75445740193741, 17.61156630688721, 11.730616660090153 ], [ 7.740257469495836, 17.688177543147187, 11.943227527123591 ], [ 1.9827577704313093, 1.0655827017826027, 14.311659691755386 ], [ 5.718508715041069, 0.9778800568029246, 14.40032760836318 ], [ 9.632500866971064, 1.2153092323081347, 14.362733849262039 ], [ 4.023305132249824, 4.499923548949694, 14.407809039418789 ], [ 7.667067303325953, 4.571009238670216, 14.328354974545224 ], [ 0.05230436048854368, 4.340972799810872, 14.311226586585732 ], [ 5.870337418265059, 7.874865634724237, 14.337042419198252 ], [ 9.72375244021592, 7.8407493876103, 14.200454180069219 ], [ 2.013512844978616, 7.77513049878122, 14.478051556309024 ], [ 7.736824880651231, 11.038007773782994, 14.069523953156533 ], [ 0.03821231621844053, 11.153804661017684, 14.417764698943595 ], [ 3.9566460998883017, 11.08541205610209, 14.669948247103354 ], [ 9.650838724154328, 14.45297292398528, 14.539976380566074 ], [ 1.9680598396738698, 14.479407313715097, 14.559855447103057 ], [ 5.906748201277806, 14.48549267172384, 14.32393407656348 ], [ 0.03980651184291518, 17.857123115576158, 14.248466652626556 ], [ 3.8293638625295965, 17.68947455490525, 14.191364730883722 ], [ 7.663657751990372, 17.590617148056054, 14.356859284460867 ], [ 0.029185068307307768, 2.2162049125016865, 15.193268302097081 ], [ 3.8981193082123213, 2.235258084340151, 15.072663486729041 ], [ 7.577462911976327, 2.172531554769059, 14.857238587968295 ], [ 1.9900721795464926, 5.453763965085865, 15.076713480815494 ], [ 5.826416407310422, 5.677415558319152, 15.331401206206184 ], [ 9.660687259262172, 5.638770136931057, 14.928377263959575 ], [ 3.9791422274504327, 8.77208561305618, 15.26842471966218 ], [ 7.798093135901091, 8.926726044256576, 15.028113551778043 ], [ 0.08053337217134715, 8.909428330605754, 15.157002655391187 ], [ 5.972186245661048, 12.238623682835494, 15.107567616651608 ], [ 9.541675487643156, 12.202352276752341, 15.057761674016739 ], [ 1.9058470465540174, 12.238962334218149, 15.346086466333661 ], [ 7.745567615325915, 15.49361982600009, 15.435341839421572 ], [ 0.09757536947199909, 15.619730606024913, 15.261653995759968 ], [ 3.9988162601570996, 15.53238504243511, 15.14544012961194 ], [ 9.596458684102702, 18.824889705917457, 14.926645995156406 ], [ 2.0057146481739245, 18.81435580491614, 15.060791106453419 ], [ 5.673838985043145, 18.824769910870533, 15.127787638322147 ], [ 11.472760125333183, 2.368910192944047, 17.615123298280544 ], [ 3.88072598889905, 2.2557280629836036, 17.405387512373327 ], [ 7.687904730238342, 2.4153157992469443, 17.213119917683706 ], [ 1.980200606929623, 5.548770652301665, 17.28908034431375 ], [ 5.794025669622396, 5.579515359969912, 17.739901358408318 ], [ 9.624979120274663, 5.562517133936406, 17.244963514532408 ], [ 3.957544562740245, 8.735096588566925, 17.621646368960747 ], [ 7.8285947978491315, 9.000825040157464, 17.504969448881333 ], [ 0.15296675616978556, 8.876688574656013, 17.483328012904 ], [ 5.77639045646437, 12.362101275578853, 17.44848493238035 ], [ 9.604844337387512, 12.27415673675442, 17.464684908726166 ], [ 1.8707033265376003, 12.295643821421292, 17.770446791623506 ], [ 7.757685345072645, 15.632500297277026, 17.84152326634042 ], [ 0.1732892947554836, 15.66964828057855, 17.578302447607168 ], [ 4.020183549777045, 15.633876788441224, 17.43151204760677 ], [ 9.568848229537199, 18.997965903714466, 17.312113245836144 ], [ 1.9685205898543534, 18.88931179615273, 17.421000032239025 ], [ 5.831576809331843, 18.914610436687656, 17.459274549731834 ], [ 11.49764063507932, 0.03599956347666613, 18.093645765101265 ], [ 3.816808420111407, 0.00728561222890325, 18.097385904691343 ], [ 7.6807861399498645, 0.25154540915978857, 18.107372664853333 ], [ 1.9853955652145798, 3.4137073022095654, 18.174707848104717 ], [ 5.86293085911378, 3.2989494066318668, 18.194555814004516 ], [ 9.44515984358627, 3.4470057177531443, 18.111793562835075 ], [ 3.793920654895865, 6.554465045624958, 18.33831678156823 ], [ 7.797240748067195, 6.736098526149007, 18.050393993783782 ], [ 0.017766526959463038, 6.558414826547157, 17.990880044846115 ], [ 5.922851420085722, 10.126903088762164, 18.125520462587147 ], [ 9.84162385513824, 10.126603601144849, 18.025753074131497 ], [ 2.1710087754225595, 9.930165065446399, 18.33058769729061 ], [ 7.713833446645079, 13.323662712864484, 18.306658636667176 ], [ 11.476446126777056, 13.450950709600447, 18.19359745362911 ], [ 3.8499593955972307, 13.412264972571558, 18.291323718785215 ], [ 9.674947477348152, 16.786189952322683, 18.272990469103757 ], [ 2.1761922149530046, 16.76566007615577, 18.27586555022998 ], [ 5.755357210725277, 16.736851671121006, 18.35516641566853 ], [ 11.171763551177499, 19.553442865679624, 19.54272120897976 ], [ 4.2023756898949305, 19.600248172764093, 19.417541144319515 ], [ 7.715365440995188, 0.8421084973688019, 19.51672107629505 ], [ 2.355516185197377, 3.9148779441519754, 19.62934800228801 ], [ 5.5941637600829495, 2.803543901322763, 19.598370615778617 ], [ 8.938311607544845, 3.7418823776365504, 19.47606563224459 ], [ 3.4006588570982585, 6.774325816748314, 19.77419058090041 ], [ 8.605845796062104, 6.652524202786465, 19.37691680090624 ], [ 11.502662812046596, 6.028773279077189, 19.35920210834208 ], [ 5.7321008453653475, 10.603913143115443, 19.57332769159386 ], [ 10.298365509052028, 10.299579585777604, 19.506827618044607 ], [ 2.1027255986748306, 9.732610362435725, 19.831695659051167 ], [ 7.741559088755704, 12.900819601604354, 19.79441060257095 ], [ 10.782003454751571, 13.587614972509256, 19.500056894142393 ], [ 4.547892250239882, 13.612593391668744, 19.59503132884556 ], [ 10.244492294198936, 16.658383611633678, 19.747696293647127 ], [ 2.2191686880376493, 17.48084687318209, 19.694117958909548 ], [ 5.280657818527124, 16.694276050693382, 19.902276827324062 ] ]
[ true, true, true ]
H18Si126
HSi7
A7B
[ "H", "Si" ]
[ 0.125, 0.875 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
144
2
3
[ 1, 1, 1 ]
[ "training_structures_diamond111_386" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/3817/MD_1082316838330432892453817.json
null
{"energy-sigma": 0.07200000000000001, "force-atom-sigma": [0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.104, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1], "virial-sigma-alternate": 3.6, "virial-sigma-paper": 3.6, "hash": "10823168383304328924538172954922463730245707879874915422723818114728998973099496294629406301656849974062979701559030475491610333383434387283557628153698731", "id": "MD_1082316838330432892453817"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_4932130883239868035483111
4932130883239868035483111186169469205507751155002068525483851636907854038817467155734724280900654047978385708026703119493921924954626366929633918087163045
2025-04-16T21:12:44
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-23,349.333871
[ [ -0.5490502851384698, -4.166353786686724, -2.8760227273751884 ], [ 1.4644810215137847, 2.7685587525300233, -1.0671927990023755 ], [ 0.2932533308317255, 0.07872441668708201, 2.5680387628327384 ], [ 0.7794143798393732, 0.6031800225540792, 0.34376578017241866 ], [ 0.5421329833851433, -0.9912014672706108, -0.3679850780671496 ], [ 0.4671451540598326, -0.3124916263897335, -0.8658875937403175 ], [ -0.6762768039164212, 1.0996571174377572, -0.37087165801007976 ], [ -0.7472850764272068, -0.6433620278289495, 0.02434425361329007 ], [ -0.917169060682267, -1.4932992554946642, 2.0733992369213703 ], [ -1.2909864340576405, 0.11758873048537634, -1.383540312040735 ], [ 0.6578304087970187, 1.9098540557226034, -0.5022312285901692 ], [ -0.4656467138792502, -0.057436178857319956, -0.10356875028514088 ], [ -0.10326895940481162, -0.56391821587329, 1.3078078906147093 ], [ -0.03551390645560937, -0.3471904924588559, 0.11569151186963908 ], [ -0.600120150112571, -0.3194400385174337, 0.3124147503406611 ], [ 0.33792037222706206, 0.5301837714097551, -0.5369748318918623 ], [ -1.106810960880537, -0.05068599894980319, 0.22064017438010344 ], [ -0.2671686960272272, 0.0807625318743634, 0.5304514234735825 ], [ 0.22062140531126634, -1.1583611083284422, 0.6418036808944076 ], [ 1.0043421294513555, 0.7562700610789963, 0.18606215026102796 ], [ 0.01901538072675116, -0.8209446727441292, 0.35725431290297954 ], [ -1.2010769378963182, -0.5759800422617007, -1.0054495045127434 ], [ 1.452455190599856, 0.4912050434247142, -0.010564157539424428 ], [ -0.0751490376288841, -0.2868515356950888, 0.026053010209060486 ], [ -0.550738472891679, 0.5922553960487701, -0.2170259716315713 ], [ -0.9137034678212393, 0.21010764143611682, -0.04815757397796956 ], [ 0.2893344521027558, -0.1489474736330944, -0.07751342608129226 ], [ 1.206752138669481, -0.7011334788200168, 1.0608352268772452 ], [ -0.8939470945412216, -0.115360353504404, -0.09598321825910802 ], [ -0.2388243167568507, 1.8487939039165344, -0.6378902014866102 ], [ -0.03443301377901912, -0.34837988577995643, -0.0032187667502933805 ], [ -0.21357092030235628, -1.210777461158705, 0.6725769833607281 ], [ 1.250577400183001, 0.2903526098095344, -0.057434379083595846 ], [ 1.2939452620600669, -0.8995868140609663, -0.20375803973747914 ], [ 0.23269043079457347, 0.5926824566424467, -1.1821780282405696 ], [ 0.5132808108140376, -0.12434970903523773, 0.26739572462699623 ], [ -0.6719547758732523, -0.12898926858544496, 0.3562842348656876 ], [ 0.6935916555844264, -0.5851303489855757, 0.30796185303669665 ], [ -0.40460687380521076, 0.6074467718328649, -1.124814097442746 ], [ -1.3871745694107642, 0.019814223149721172, -0.24437430470092236 ], [ -0.3163066324637692, 0.3831438008136786, 0.9979483047412113 ], [ 0.3820801345427334, 0.10846104948831865, -0.4195041151406807 ], [ -0.48195600625654555, 0.898173991687545, 0.5208144065126035 ], [ -0.4239341296072959, 0.04682342742734472, -0.0974433489704201 ], [ -0.22204708321128847, 0.3959787585718579, 0.9622495358130834 ], [ 0.9239074135053111, 0.7709693273048148, -0.6128656334056091 ], [ -0.0868969320577047, -0.37457584944481714, -0.056823227348996655 ], [ 0.7602601594253341, -0.6079779621920076, -0.452724595650718 ], [ -0.6403126969192539, 0.5970309670704131, -0.6433178048174429 ], [ 0.6549898516393192, -0.7216915227388567, 0.37395415617840533 ], [ -0.2684012839177061, -0.7679480214431088, 0.19982759103456876 ], [ 0.7016201890571208, 0.43141578897839483, 0.597236912606557 ], [ -0.9404763875199414, 0.3812200998131438, -0.6593545600308026 ], [ 0.37490957891537235, 0.32319385228484987, -0.24611417167106658 ], [ 0.01697572287627769, -0.9824573951873192, -0.2319391538200262 ], [ 0.3801088680937758, -0.34537889165027963, 0.8229195387405348 ], [ 0.31326141532258583, -0.09216178442177192, 0.30596230442921746 ], [ -0.7050037636584356, 0.44753173423561493, 0.16324127654992565 ], [ -0.7590342564086874, -0.4459541040111721, 1.1448175539440302 ], [ 0.34867813399709363, 0.9652009076100814, 0.12349764473214067 ], [ -0.7760732284758407, -0.23853146786088586, -0.3308326061910098 ], [ 0.7467667415946649, 0.8981500804080675, -0.3001765461272882 ], [ -1.0390790478792162, -0.6905410391220707, 0.9364577499045499 ], [ 0.7117703986400014, 0.5424620848661224, -1.351041026572999 ], [ 0.9440561374571834, -1.1369137190793628, -0.9802105062480417 ], [ 1.3810157437268815, -0.8389202984794125, 0.6332637545735359 ], [ 1.7074916119529007, -0.3247532276615197, -0.7135840563328338 ], [ 0.339969286056688, -0.13039617741662995, 0.900690589574906 ], [ -0.7426917967727622, -0.7389978897593055, -0.6537804036967215 ], [ -0.5211555921885872, -0.5198546128965923, -0.5939618386497524 ], [ 0.46521476818546537, -1.057376576000582, 1.028015838797151 ], [ -1.02084528316979, 0.5911189674972647, -0.6211019121881716 ], [ 1.90222507201666, 0.6713382248174807, -1.0980954280662993 ], [ 1.565798511980604, 0.031695557944657456, 0.19974274455900387 ], [ 0.9868138760417781, -0.2957383041236486, -2.319163481158365 ], [ 0.08594639442084596, 0.015315817281590092, 0.5689660669483367 ], [ -0.4359831004691059, -0.1106061226569182, 0.01570071174801626 ], [ 1.0139452078221085, 0.189517972921839, -0.19775065215695317 ], [ -0.09523939748998918, 1.1077381014589824, 0.2979515115832321 ], [ -0.5722714799479192, 0.9698265831915597, 1.24118258134318 ], [ -0.13063169066395555, -0.7476123781344616, 0.4355940922341674 ], [ -0.07703082961270047, -0.4830510400123966, 0.7072534808135652 ], [ -0.08348944617691244, 1.0155194956096354, 0.04229339696377583 ], [ 0.6711909004826363, -0.2017896015043738, -1.1644602843688974 ], [ -1.222813576493914, -1.2232843458780334, 0.9987414907324771 ], [ 0.3067999705425217, -0.08190461685757318, -0.6851406895076317 ], [ 0.27651389253436937, -0.1930272745733091, -0.01627355401334525 ], [ 0.12352387000640618, 0.21164876196501362, -0.5980825491463537 ], [ 0.37608508826774406, 0.0239002237245005, 0.35503981989073596 ], [ 1.2097341066197886, -0.04057358461512878, -0.3613158879772175 ], [ -0.9802040784847414, 0.04254305129036221, -0.18906777238028108 ], [ -0.7288939600721875, 0.04968121099068931, -0.36918989802017094 ], [ 0.6997967611640717, -0.6790314861564278, -0.09496223233647721 ], [ 0.6648639245108159, -0.4127390228223072, 0.16331069639356963 ], [ -0.6791824100387206, 1.1507601496704882, -0.5794371504751719 ], [ -1.2038935837745404, 0.11598950297624425, -0.44051441648533474 ], [ 0.12396147213189539, 0.22514577934313096, 0.7310829991417617 ], [ -0.07576096069507934, 0.15104421002167517, -0.6301493746992405 ], [ 0.12542185995373947, 0.3724104645441884, -0.7807205013420084 ], [ 0.2237856646287726, -0.10663582182154555, 0.44810560494307194 ], [ 0.6890827081844827, -0.04121070451346147, -1.2774765611529224 ], [ 0.9045351633601234, 0.058898623563420176, 0.2551251244865896 ], [ -0.04270811625191571, -0.847962618779841, -0.39168629823987056 ], [ -0.5120248258651453, 0.09628352336050132, 0.2629947636504988 ], [ 0.5918656164822357, -0.9385938242045291, 0.8702129642204026 ], [ 1.2581827297199992, 0.8112572621188752, -0.4181393724367461 ], [ -0.002070254003783233, -0.8819163785271846, -0.2771093605265157 ], [ -0.34508681408591074, 0.7844048952657806, -0.31085023275335094 ], [ -0.7610867697857616, 0.4635723461069548, -0.22598524523015925 ], [ -0.9736822127296538, -1.6664829963176027, -0.6646330392530665 ], [ 2.058424862426296, 0.8286677589047898, 1.2524597063878817 ], [ -0.2621249587206927, 0.0683548918203928, 0.17892219078697677 ], [ -0.26507195963864644, -0.5288696794806275, 0.48619524470840575 ], [ 0.9443746974063498, -0.5554469380644661, 0.9729710449981007 ], [ -1.676486138676171, 0.005836409076736139, -1.060381169677707 ], [ -0.7439742641064521, -0.19371530235698073, -0.8078826863861809 ], [ -0.4511526218579795, 0.05128763759471783, 0.614774421995287 ], [ -0.08104123969106744, 0.48130808771586825, 1.0591724930667055 ], [ 0.7235573738696882, 0.021559489441037687, 0.0021134485731617208 ], [ -0.7653015827370804, 0.8080007001203756, 0.1398300770573173 ], [ 0.478631824188126, -1.038452726623228, -0.6740216874401193 ], [ -0.6958385445237039, 1.822548317918995, 1.117085611960913 ], [ -0.5677789876220244, 0.3772852802311892, -0.9186412755885838 ], [ -0.36069753714772185, 0.8418410741231006, 1.2188594736220584 ], [ -2.1069012534639637, -0.15476691341471757, -0.04744820602014071 ], [ 0.08962898857089405, 0.8331517665831283, -0.9518563567774486 ], [ -0.43213312736271603, 0.8201656278321242, 0.22244251920952726 ], [ 1.8132375742231428, -1.609000794675052, -0.08813286238509989 ], [ 0.745501243556088, -0.9485419449092458, 0.6630829198555492 ], [ -1.114464627197554, 1.8571970474343744, 0.5309054806731208 ], [ 0.7195806452710152, 0.12413167930408919, -0.6952461618579416 ], [ -2.0368337483898205, -0.8232231862788443, -1.0576216023375922 ], [ 0.9833801648867204, 0.8738922159335345, 1.1368957213421218 ], [ 1.023340283772462, -0.6875205045919608, 0.1335604367341362 ], [ -0.30118236252853015, -0.10200526113995884, 0.26257515926225067 ], [ 0.957865287021167, 0.3297152038188734, -0.8237325222427657 ], [ -1.5144856775537485, -0.5128007854507659, 0.9957572087873813 ], [ 0.8492998506568502, 0.7696930306238934, 0.13705456886421744 ], [ -0.6021415531152715, 0.029508061538275475, 0.4825789850756174 ], [ -0.7446396661633065, -0.8679465348806921, -0.1217878596942422 ], [ 0.24742183583689392, 1.246476744307897, -0.021222160423034257 ], [ -0.0013667995881907187, 0.04658534307469902, -1.3281306783967557 ], [ 0.7989162136926964, 0.42220943215854057, -0.7263105134465028 ], [ 1.3690207660767946, 0.033465763957579414, -0.3694122986303638 ], [ -1.044475283725143, 0.05604212555273567, -0.2223502165285339 ], [ 1.4132725739629273, 0.38157002724721595, 0.43358503053700365 ], [ -0.486130452854338, -0.2795004884742534, -0.12025985180247818 ], [ -0.21731547809061996, -0.09383968775370057, -0.9736274481863346 ], [ -0.11319188327739113, 0.6446429524994473, 0.8552882120580071 ], [ -0.32737138420902645, 0.37467843654709104, 0.5925184201230212 ], [ 1.0456245678032494, 0.36978510890178523, 0.7998407831658217 ], [ -0.42418866903399055, 0.17426463349952853, 0.4190498008306105 ], [ 0.19793602885053582, 0.5257954088493264, -0.24570125215665084 ], [ -0.4675788995273415, -0.5770987301864973, -0.7566174174077482 ], [ -0.4495829620600291, 1.2954282756087283, 0.002829244294290946 ], [ 0.1285524377915518, -0.3992003535380033, -1.1038680737310955 ], [ 0.48086251516388656, 0.7369710874354327, 0.8860154917390969 ], [ 1.1391292405337343, -0.21231724934825214, 0.23305089976045823 ], [ -0.3134359933738239, -0.7032330434244497, 0.11138413912679501 ], [ -0.037818131043526076, 0.4648422150245759, 0.2654278006149549 ], [ -2.068594098188546, 0.882789783004439, -0.4458335191716571 ], [ 0.6561465919228537, 0.3971789505353029, -0.11898638333740885 ], [ -0.4895253403190615, -1.4776859613275333, -0.10350087310468899 ], [ 0.551694666960242, 0.2740970535334302, 1.2340233385792279 ], [ -0.026451531533683438, 1.1433705358698507, -1.2694259161744748 ], [ -0.09341391271268404, -0.4891293900997587, -0.5006906222823366 ], [ -0.20449954651180988, -0.16962507394932133, 0.6144784877729379 ], [ -0.3609867864962385, 0.5753426652528361, -0.04794828600490951 ], [ 0.08023134151522081, -0.4160485495904017, 0.010969877958943794 ], [ -0.046247242725099544, 0.47310137664448754, 0.5862374669364315 ], [ -0.7249912793067349, -0.13357457781339704, 1.480585911018128 ], [ 0.48285820711338556, -0.43030789969594296, -0.6998672094498438 ], [ -0.4512379825546084, 0.09758578820515632, -0.9481377671529186 ], [ -1.6064749408085384, -0.6197027166729469, -1.189892372643142 ], [ 0.3344856326298762, 0.9906029139520803, -0.06806230003495996 ], [ 0.6381653097558663, -0.5538531098765064, 0.05887111273649459 ], [ 0.817140465312438, -1.3342943891807466, -0.6719174948461101 ], [ 0.45528541654958554, 0.3546490118820735, -1.882121856628954 ], [ 0.5378289530792155, 0.15654406141200392, 0.5360967994250317 ], [ 0.2012270436603254, 0.19612725625781166, -0.5830716649557331 ], [ -0.5375386752885708, -0.23344556442710096, 0.44686761773142064 ], [ 1.393312826252086, 0.3496525829134297, -0.19429842904359035 ], [ -0.1396930371437534, 0.03842311212535692, 0.506288947006427 ], [ -1.2347967270595281, -0.18835609042766407, 1.212375917336241 ], [ 1.1438515896752506, -0.39577358436730997, -0.30869487516347077 ], [ 0.5971821480632378, -0.46792471319290146, -0.22933308146752407 ], [ -0.3923118481642626, 0.008059386736536169, -1.0414256957049155 ], [ -0.1355949523739694, -0.4963243712276611, -0.40927342996127947 ], [ -0.1571845237472528, 1.043588252389692, -0.1224108385133141 ], [ 0.7340716519659019, -0.4629545094985231, -0.34425429018324677 ], [ 0.7211166235892716, 0.7409704417609231, 0.3902950731511385 ], [ -0.41144395707254855, -0.18610637327253454, 0.8540859632103058 ], [ 0.5501895419058274, -0.7128060398629571, -0.937466908742708 ], [ 0.08725920079731356, -0.5849277458863481, 1.4152659519176383 ], [ -0.5999972512782681, -0.5973284439559543, 0.1460025295993968 ], [ -0.1453756941223447, -0.6487217539793301, 0.26569956644729464 ], [ -1.217618401084023, -1.1417463686391132, 2.732752254288981 ], [ -0.6069477202902243, 0.7064608090433635, 0.024861560003703865 ], [ -0.1221074480855366, -0.9944947960751884, -0.1915265203979387 ], [ 0.8331815914048419, -0.7749249728398626, 0.36274490831415573 ], [ 0.20801579014764437, 0.21730210834295519, 1.124659574013005 ], [ 0.5767030370777264, 1.29976341628903, 0.891644155505965 ], [ -0.4539029332189418, -0.4318868154730459, -0.8740709077532848 ], [ -0.32441409886979217, 1.0071112098811552, 0.7751687136242128 ], [ -0.3629122872704974, -1.0835627694652261, 0.25228456732888993 ], [ 0.11500656941235164, -0.22253507900105257, -0.021622995742445344 ], [ 0.38627720686734307, -0.7046376382608466, -0.880652680262332 ], [ -0.6679888459169239, 0.7236550758718538, -0.7065078602707223 ], [ -1.1772093672093837, 0.7612086401779367, 0.7862113538637167 ], [ 0.39950914328695314, 0.14186870646566271, 0.45137733646296035 ], [ -0.5862048138988656, -0.8717800529130327, -0.13284952611311526 ], [ -0.23805349938187031, 0.8123270990425887, 0.2224358343356949 ], [ 0.6540418851077806, 0.9413603335290083, 0.9051036347464081 ], [ 0.5291833543296856, -0.8200375867871808, 0.25035598122824687 ], [ -1.3541898592585844, 0.10997131675337363, -0.8569085226307644 ], [ -0.26290914584333785, -0.4770724488114562, 0.3570694504304609 ], [ 0.077595701451537, 0.18746160288678457, -0.8443026503566102 ], [ -0.41332420639317285, 0.032183039513357534, -0.06675103632168443 ], [ -0.8077883268209314, 0.5365030340656152, 1.0149960185664533 ], [ 0.1461706798873345, -0.1404342868075521, -0.07399975355077791 ], [ -1.575331913397181, 1.7773775969914416, 0.7668329330657606 ], [ -0.1504302300712238, 0.005874975656538361, -0.4462873192606633 ], [ 0.09358566254806994, 0.015918741479164816, -0.07623018741600636 ], [ -0.061064779795644945, -0.021222674644098292, -0.10664944867974231 ], [ 0.1433979999100868, -0.0646686981228965, -0.013004907819840998 ] ]
[ [ 71.45983971772093, 7.92596169476984, -3.071803064788908 ], [ 7.925961694769839, 78.81797132092515, -3.5449948077602422 ], [ -3.071803064788908, -3.5449948077602422, 77.83609845425964 ] ]
true
null
null
null
null
null
5.092295
1.176066
null
CO_5641126316932427061503174
5641126316932427061503174203922617782435597596808647718670877018761245211372253671736280585262374577827203484999936834422152831049944160647914230124324084
5405597415365465821389616374322973659424777994822649348459411963588791855980711575887416127472926092129391418487333975852378125763643440967867036681531314
[ [ 16.254729908999998, 0, 0 ], [ 0, 16.254729908999998, 0 ], [ 0, 0, 16.254729908999998 ] ]
[ [ -0.5246701720027019, -1.8399704067791638, -0.7483840197402689 ], [ 0.269617205000583, 0.23167866539297696, -0.23605118773849798 ], [ 1.3841715254008948, 1.4219150082495928, 1.2483795117411087 ], [ 2.7196276252645166, 2.6893613181739586, -0.031582940213187 ], [ 4.045688491240736, 4.087723222785411, 1.3350172221560788 ], [ 2.589638550182244, 0.09406612198338299, 2.8301272791858985 ], [ 4.095037851244461, 1.3297019254758358, 4.110512354117829 ], [ 0.09821107811017799, 2.7881900760206784, 2.6806325282128256 ], [ 1.3344483066092638, 4.289997081773007, 3.9409430117071405 ], [ 0.07137451903041898, -0.03641059499615999, 5.5408635671901925 ], [ 1.3532712838438858, 1.1757696332376057, 6.913542998545425 ], [ 2.596237970525298, 2.673529211242593, 5.389857126335583 ], [ 3.972330895161419, 4.047509020990544, 6.638561732674871 ], [ 2.7981054612651683, 0.006014250066329999, 8.237702061122292 ], [ 4.160853252646001, 1.467720837133155, 9.45485623670821 ], [ 0.018302825877534, 2.711418986660472, 8.102852821797226 ], [ 1.3941356748351117, 4.122703401549578, 9.454124773862306 ], [ -0.14866575974771398, 0.17208882554658297, 10.858761004218632 ], [ 1.2684541031787238, 1.5893062168524748, 12.084026290029142 ], [ 2.696318342575011, 2.7451475512216468, 10.748570190165522 ], [ 4.144679796386547, 4.144972381524908, 12.119591639070036 ], [ 2.7030315460274275, 0.22922420117671796, 13.497651386025145 ], [ 4.006823432028318, 1.4230853488030408, 14.84606250562624 ], [ 0.06245067231037799, 2.863010597791806, 13.561760040786242 ], [ 1.416567202109532, 4.035415501938249, 14.983008605109566 ], [ 0.11275906137873298, 5.465230308923616, 0.0038198615286149993 ], [ 1.4604712275937408, 6.800800191896601, 1.3574975136202259 ], [ 2.6627523253129253, 8.204168553320024, -0.11407569450136198 ], [ 4.123906251562845, 9.507521561613371, 1.28639932499826 ], [ 2.8414893353922897, 5.365361248362719, 2.7386456592580464 ], [ 4.001329333319076, 6.898149769321601, 4.057782010293033 ], [ 0.04713871673609999, 8.188060115980205, 2.5980585002751058 ], [ 1.2019560031210048, 9.464641584113428, 4.07050946381178 ], [ -0.24526761959690097, 5.504713047872576, 5.431566763282076 ], [ 1.246770293480118, 6.619283623002797, 6.85996740876536 ], [ 2.502025555972734, 8.078308179634636, 5.427243005126282 ], [ 4.054986196748684, 9.397607077968713, 6.701890160400335 ], [ 2.7300306524062767, 5.453721960148043, 8.106900249544568 ], [ 4.095281672193096, 6.7523936062275975, 9.557179761485367 ], [ 0.134946767704518, 8.083005796578338, 8.178258513845078 ], [ 1.401043935046437, 9.415259714649887, 9.498500186513876 ], [ -0.22520928288919495, 5.28293351299418, 10.900113037107127 ], [ 1.28168545332465, 6.554085901337798, 12.19329058447744 ], [ 2.6771865254721177, 7.990565147585856, 10.911019960876066 ], [ 4.1597966952019165, 9.2830762510299, 12.128417957410623 ], [ 2.6980088344855466, 5.306697928121139, 13.602234318259653 ], [ 4.104839453379587, 6.794867215479815, 14.867274928157485 ], [ -0.12277197500267699, 8.046595201582178, 13.642367246404971 ], [ 1.3244028835255017, 9.47941713360071, 14.876913982993523 ], [ 0.040490532203318996, 10.881793956499685, 0.052681579635069 ], [ 1.5205324546074959, 12.219346916521568, 1.2949168034705758 ], [ 2.8101502161277376, 13.512118095644157, -0.08367934957153199 ], [ 3.9269476892554915, 14.940502486397529, 1.447191113258088 ], [ 2.7093546359620286, 10.760484907188818, 2.7757226981804757 ], [ 4.06108172046456, 12.147858614381786, 4.1791885879833535 ], [ 0.18057379455908099, 13.630826388169583, 2.559274714712232 ], [ 1.359106731881217, 14.883253327658034, 4.116299037965432 ], [ 0.10789889713594199, 10.932801298954127, 5.418221630026788 ], [ 1.3865122065077908, 12.300945660664748, 6.814031542042526 ], [ 2.7630765183112738, 13.523496406580454, 5.483370587502059 ], [ 4.176750378497004, 14.96099970081278, 6.833017066576238 ], [ 2.646660142703016, 10.73556640623832, 8.072667788356213 ], [ 4.0062382617515935, 12.232903361265674, 9.376459674357104 ], [ -0.10949186066702399, 13.572439398336453, 8.335685573013745 ], [ 1.1991926990364747, 15.120068487702254, 9.61984174528456 ], [ -0.27067376244466795, 10.72825177777927, 10.736557944762769 ], [ 1.14774647887449, 12.010896260168552, 12.109887565314361 ], [ 2.5569177788754267, 13.590595931644808, 10.762370455858262 ], [ 4.036780899250605, 15.0419482557596, 12.205449122449373 ], [ 2.74477369243374, 10.779226610773893, 13.463126339698428 ], [ 4.036049436404699, 12.268907588014107, 14.673030905744934 ], [ 0.05284412693415899, 13.536581464157202, 13.34836794654089 ], [ 1.54826302383225, 14.90669264818681, 14.866510955851762 ], [ 5.152863164262362, -0.013345133255288999, 0.007282118999231999 ], [ 6.574127983315596, 1.2611232199897648, 1.516094913342339 ], [ 8.053600990172958, 2.560152470127318, -0.008013581845136999 ], [ 9.492648483746637, 3.967893353896262, 1.3413890762804068 ], [ 7.992076837467391, -0.116367611418531, 2.69893535409036 ], [ 9.382994075780521, 1.22999541221403, 4.065421733350263 ], [ 5.3952862061251885, 2.7133858089794605, 2.689735176961866 ], [ 6.72651607621247, 4.163242697942624, 4.074800712507756 ], [ 5.474121646183838, 0.06230437974119699, 5.404258817034957 ], [ 6.8236055779589275, 1.2600991720054977, 6.835178945654135 ], [ 8.052999565166324, 2.792091211198839, 5.575746217574907 ], [ 9.581886950947046, 4.171922723714031, 6.80943145347828 ], [ 8.287100185315742, 0.017067466404449998, 8.131948788334338 ], [ 9.58099294080205, 1.3483135912216409, 9.524654046937457 ], [ 5.447658945891987, 2.7612072243717387, 8.073756855260116 ], [ 6.824011946206652, 4.119826314355686, 9.394843773884183 ], [ 5.395773848022459, 0.07602337178439299, 10.837727383716386 ], [ 6.957138184161362, 1.3615449413675669, 12.125134501969002 ], [ 8.275510562890624, 2.7747474143859354, 10.80581934890502 ], [ 9.601798995085572, 4.081270095011538, 12.174890230220452 ], [ 8.027609677048465, -0.08658894622524299, 13.539978702708183 ], [ 9.449443411648515, 1.162993415529132, 14.901003492718662 ], [ 5.56626971003796, 2.671578643653513, 13.479819947314972 ], [ 6.794607139801271, 4.005100430657963, 14.856042909790366 ], [ 5.438540042413037, 5.3815184498922655, 0.006810731831870999 ], [ 6.789990796507115, 6.665382037024721, 1.3955498363371948 ], [ 8.092287247356378, 8.130648409941617, 0.040327984904228995 ], [ 9.37439532365866, 9.539738436293009, 1.5075449254102047 ], [ 8.163889332605523, 5.4013979845709725, 2.7069651906654055 ], [ 9.532992723380774, 6.82615757055464, 4.101214648609881 ], [ 5.416612411765796, 8.05989157064774, 2.5861275285218994 ], [ 6.750930680535788, 9.330962685341811, 3.9595871869127635 ], [ 5.232836435414643, 5.440539374191844, 5.4059167994856745 ], [ 6.637245099552242, 6.837958504468575, 6.771314111841674 ], [ 8.114978850309342, 8.019482312093967, 5.459086021018013 ], [ 9.44398182239909, 9.408107633489927, 6.835048907814863 ], [ 8.139929860719656, 5.60201386110785, 8.070635947117589 ], [ 9.390747581947116, 6.914680829639055, 9.304955117487413 ], [ 5.414109183359811, 8.175170115162368, 8.188190153819477 ], [ 6.820728490765035, 9.588600154399462, 9.46104928880354 ], [ 5.526185546082365, 5.525063969718644, 10.780884593224613 ], [ 7.169392447313084, 6.764698436768711, 12.191486309457542 ], [ 8.323266959363266, 8.305906907820455, 10.868335040135033 ], [ 9.59467942338543, 9.662217826157324, 12.197874418311779 ], [ 8.222422615007831, 5.258583927590498, 13.49236859880472 ], [ 9.385903672434234, 6.835357747683135, 14.818218153292124 ], [ 5.651249438002211, 7.947880226844821, 13.491165748791456 ], [ 6.75367772989041, 9.487008092468212, 14.926247088267337 ], [ 5.416124769868527, 10.802259563054948, -0.14354551982637898 ], [ 6.671900183718231, 12.174776447111089, 1.548506844780885 ], [ 8.053487207063593, 13.451829302411674, 0.034687593625806 ], [ 9.538161727491836, 14.867795079514574, 1.3359599964908009 ], [ 8.039296827853038, 10.795026208245444, 2.8845643696511396 ], [ 9.514933718451875, 12.086090640727585, 4.08219661461635 ], [ 5.135161763391461, 13.691440276000243, 2.835670142084868 ], [ 6.683408532493802, 14.89318496763243, 4.077027610505289 ], [ 5.51943983317013, 10.581032688993457, 5.354275522564782 ], [ 6.584791086135899, 12.211317079946522, 6.753580201510956 ], [ 8.22050455687857, 13.52048928154729, 5.472041040755487 ], [ 9.539998511971554, 14.761814240507894, 6.747956064962441 ], [ 8.006657330195765, 10.959962952632065, 8.038061468379953 ], [ 9.478198028857534, 12.250263412808485, 9.332214299544807 ], [ 5.408387518431843, 13.608492389274616, 8.26128767422025 ], [ 6.945889911064334, 15.020231936601176, 9.43733363786631 ], [ 5.274253487222775, 10.780592008086252, 10.757949169323012 ], [ 6.7921039113952855, 12.191291252698633, 12.05335361469086 ], [ 8.232045415113959, 13.608281077785799, 10.767490695779596 ], [ 9.453035706958403, 14.746193445065343, 12.292997097739248 ], [ 8.080795153310714, 10.853705783216933, 13.624925921212615 ], [ 9.364918816121714, 12.205839235967188, 14.953148666266733 ], [ 5.368547175424884, 13.629704811805862, 13.461419593057984 ], [ 6.734497148597789, 14.885528989845291, 15.00147397828619 ], [ 10.753007731430678, -0.01592963531082, 0.038247379475876996 ], [ 12.245354484375968, 1.348021006083279, 1.3211194280838838 ], [ 13.61299494945941, 2.735280930166884, 0.07951813871482799 ], [ 15.019581747404814, 4.059846360991476, 1.2917633858682298 ], [ 13.551925929191295, -0.028039409093024995, 2.6768451761440284 ], [ 14.892177174378073, 1.3192663888742577, 3.9991511995112696 ], [ 10.861963186010705, 2.5969694333712026, 2.703584206844334 ], [ 12.20291338458357, 3.9218599587939744, 4.135934751695504 ], [ 10.822415428142108, -0.091237798979217, 5.377194691736471 ], [ 12.122224905315294, 1.128582152311779, 6.771362876031401 ], [ 13.510037490215804, 2.503179641796273, 5.545739986162893 ], [ 14.796583107783245, 3.9470385354230157, 6.698184081981084 ], [ 13.487362141992747, -0.008728789961133, 8.124309065277107 ], [ 14.873321687683633, 1.4441839882249228, 9.365552750588165 ], [ 10.915782596739403, 2.650431240041904, 8.109533515789826 ], [ 12.296134260611684, 4.01426809832664, 9.556171968231007 ], [ 10.813719147640793, -0.16433531937998996, 10.88626400722466 ], [ 12.206765755572002, 1.3946070620024729, 12.16027722803226 ], [ 13.542839535172165, 2.631348187128738, 10.778722714146715 ], [ 14.689887060660569, 3.9367980555803452, 12.409917369974682 ], [ 13.557355008980903, 0.050584719476807996, 13.579461441657143 ], [ 14.945834037807682, 1.4774736750785549, 14.77342011766292 ], [ 10.842912642557357, 2.5770411345027684, 13.586889853225555 ], [ 12.080482758908982, 3.9907800136081346, 14.994907067402952 ], [ 10.720725837831404, 5.4397916566160305, -0.037613445009426 ], [ 12.299368951863574, 6.701288735393702, 1.2359934075504508 ], [ 13.485395319673758, 8.303143603735926, 0.106972377531129 ], [ 14.947687077017308, 9.557244780405002, 1.4393888429017678 ], [ 13.698039696343297, 5.386248576295785, 2.8357189062745944 ], [ 14.869079203177384, 6.88922592260156, 4.029157430923283 ], [ 10.856712908250099, 8.143408372920181, 2.6752359578830376 ], [ 12.155173242840837, 9.639509968474451, 4.084098418015703 ], [ 10.839385366167104, 5.380721968126725, 5.44775647427144 ], [ 12.21006546574353, 6.740560162853846, 6.613496939155193 ], [ 13.53479344386721, 8.219074140646578, 5.422870482780762 ], [ 15.065680161426739, 9.510512431916625, 6.766909080036335 ], [ 13.391020357822105, 5.347399771813275, 8.067254963296518 ], [ 14.835805771053662, 6.735683743881146, 9.383888085925516 ], [ 11.010596436298602, 8.150739256109143, 7.966784477728988 ], [ 12.042089086863923, 9.558707706096813, 9.522280856370744 ], [ 10.76988014107622, 5.564790529616241, 10.785435917599132 ], [ 12.173394795068823, 6.821004821173488, 12.270272985326466 ], [ 13.471903893849289, 8.137979293130575, 10.813475326692158 ], [ 14.810871015373255, 9.325533605552208, 12.250133374969215 ], [ 13.312363719792454, 5.41215861577073, 13.676827273812052 ], [ 14.723225511703927, 6.707871901006847, 14.99092465857525 ], [ 10.88658910182284, 8.263612100597237, 13.523691463339363 ], [ 12.063399037774621, 9.657731520702441, 15.063875886406839 ], [ 10.736736746791768, 11.013749853900945, 0.05336427829124699 ], [ 12.329310164355952, 12.262308167671055, 1.3857644889319767 ], [ 13.620504634677369, 13.673885167698524, 0.02064350698443 ], [ 15.006447925638344, 14.99477702956368, 1.4850808886759668 ], [ 13.687831725960447, 10.890327689701909, 2.8133361431899018 ], [ 15.11164853760939, 12.359040065359514, 3.9976232548998234 ], [ 10.736216595434682, 13.500463454299402, 2.6434742156408517 ], [ 12.127085069558083, 14.821420335084197, 3.889724357763882 ], [ 10.727227729795004, 10.69702644162408, 5.427746901753461 ], [ 12.312957906067497, 12.11364240792334, 6.698736742797989 ], [ 13.615303121106487, 13.528584137041973, 5.2322512651379185 ], [ 14.880993920200682, 14.946289170245134, 6.769119723303959 ], [ 13.552966231905472, 10.769278716069588, 8.117498333445235 ], [ 14.74853412617224, 12.189145628350644, 9.521890742852927 ], [ 11.021031972900179, 13.407730220168558, 8.097261194708532 ], [ 12.300197943088934, 14.77163209737293, 9.430067773596985 ], [ 10.773017303948656, 11.022218568183535, 10.78498078516168 ], [ 12.162048993592343, 12.324596292682342, 12.257691824376899 ], [ 13.501861361071576, 13.454478823386841, 10.846147333809247 ], [ 14.778182753526258, 14.8692905146662, 12.078938559567625 ], [ 13.449407347655233, 10.872821345589916, 13.532322724921043 ], [ 15.020264446060992, 12.138333342655113, 14.883594676986121 ], [ 10.858500928540087, 13.595634897916598, 13.681378598186573 ], [ 12.201678025110485, 14.978441026005136, 15.019939351462813 ], [ 14.114126647080889, 13.031382833112488, 13.871658091974318 ], [ 0.7003561692781466, -3.064996748060012, -0.7483840197402689 ], [ -0.9489625103983562, 12.618720753966725, 12.331338754648597 ], [ 15.458108352781782, 15.539242211649563, 0.15164037532106098 ], [ 14.8420865986905, 14.821420335084197, 3.889724357763882 ], [ 12.24799425251319, 6.82615757055464, 4.101214648609881 ], [ 14.837226434447707, 1.128582152311779, 6.771362876031401 ], [ 9.50499232563953, 6.665382037024721, 1.3955498363371948 ] ]
[ true, true, true ]
H8Si217
H8Si217
A217B8
[ "H", "Si" ]
[ 0.035555555555555556, 0.9644444444444444 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1 ]
225
2
3
[ 1, 1, 1 ]
[ "training_structures_interstitial_84" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/0825/MD_7929955026063253414840825.json
null
{"energy-sigma": 0.1125, "force-atom-sigma": [0.255, 0.165, 0.129, 0.1, 0.1, 0.1, 0.1, 0.1, 0.136, 0.1, 0.104, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.115, 0.1, 0.127, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.102, 0.127, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.112, 0.1, 0.1, 0.106, 0.1, 0.1, 0.121, 0.1, 0.112, 0.1, 0.122, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.115, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.105, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.16, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.125, 0.1, 0.1, 0.1, 0.1], "virial-sigma-alternate": 7.881797132092515, "virial-sigma-paper": 7.881797132092515, "hash": "7929955026063253414840825995064148653940367587001409988577540468568972819334714183109990173821124503439727764807610184068943993373042376397177041059684099", "id": "MD_7929955026063253414840825"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_4959916223932929622926107
495991622393292962292610744696733921969453661339625851945030478556812126905704836457410565094622952965016243259433835883983908367664248462899594971212633
2025-04-17T18:16:17
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-46,826.846407
[ [ 0.825578575862632, -0.162847897435943, -0.31467500902760326 ], [ 0.7370988713698441, -0.38623246963477254, 0.353477616298214 ], [ -0.2592437780989348, -0.13319482555761117, -0.3444671777037551 ], [ -0.8276028070811845, -0.7193950114669004, 2.613816778836911 ], [ -0.008652797844426345, 0.19482216319730447, 0.45030261443913855 ], [ 0.018072299295320848, -0.049784055203495235, 0.03218021129750537 ], [ 0.03796879781528675, -0.02393981874643078, 0.01632214790389605 ], [ -0.04248031632055059, 0.03487035879397631, -0.012166727485472725 ], [ -0.053503416159621446, 0.006790032039979061, -0.014968203842306071 ], [ -0.010175149304486021, -0.022822673484826438, -0.002126561210294476 ], [ 0.030065734282215595, 0.13297962404231478, -0.01357877852729805 ], [ -0.511845619824331, 0.3591003665228459, -0.0974032397274258 ], [ 0.2471472417887021, -0.6792564578719408, -1.782888504134647 ], [ 0.05373584408056283, -0.10217752519640876, 0.024611648566585473 ], [ -0.07212567488292197, 0.06342813980592504, 0.05455165579864582 ], [ -0.1307041958339837, 0.2968644482538735, 0.22721911867329836 ], [ -0.22226382738977696, 0.032155785796963966, 0.13039463475343788 ], [ -0.042981681857979466, -0.0049802310051268285, -0.09523014151083663 ], [ 0.1124503765030604, -0.16496391711442485, 0.006313092003091593 ], [ 1.0575367558620272, -0.5448272446501266, 2.048056108891203 ], [ -0.06252593894908509, 0.26884402825383563, 0.189952232610412 ], [ 0.0006106375135351688, 0.07502999545256124, 0.04199206342025447 ], [ -0.047362845323511794, 0.007053827445826254, -0.004272405710490063 ], [ -0.038554238496684476, 0.16689301743613194, 0.055108814321521905 ], [ -0.2911216274107908, -0.29431751132373474, 0.4087633226657621 ], [ -0.25157288537627304, 0.7757508118686942, -0.46764909070258154 ], [ -0.34487958299710686, 0.06759255909296889, 0.24008544391638334 ], [ -0.2036479964297768, -0.1552415394568169, 0.052817702370737955 ], [ -0.11464198667795465, 0.22837225940938474, 0.08165470542045478 ], [ -0.07968703851894546, 0.17784001255772644, -0.1342700618024971 ], [ -0.7308063482093137, -0.21521051416501474, -0.3941309051782674 ], [ 0.6527344780524853, -0.37189752903281886, -0.01619873484852894 ], [ 0.12988092791047232, -0.007876838258805655, -0.010606580777206871 ], [ -0.15537729381772075, 0.23766114871001573, 0.2100083967707591 ], [ -0.05236210250800773, 0.009569911112123164, -0.015908971278948254 ], [ 0.002714572997012342, -0.05298405288495154, 0.017198894818066544 ], [ 0.41919403983907083, -0.82731638594852, 0.1441289651526049 ], [ 0.3117555189365751, 0.22397078421182326, -0.007969655160863 ], [ -0.9263494493383878, 0.41644835646768474, 0.10272542774013231 ], [ 1.1575463250524871, -0.21514083721083874, 0.28215386916464624 ], [ 0.5905494676688519, -1.7807074354915653, -2.887965254476744 ], [ 0.12739518328695315, 0.06593008239296115, -0.09306655638393203 ], [ 0.07534264185949124, 0.6090336580364604, 0.21280036003790792 ], [ -0.06613859903442515, 0.5290763963483673, 1.8090816395836553 ], [ -0.6986469628649015, -0.08802667573537776, -0.41765806152081436 ], [ 0.04864582687826568, 0.07257021899277558, 0.14644655948818636 ], [ 0.07581341124361037, -0.02127203986624513, -0.22298939331112277 ], [ -0.06663636502440581, 1.0370149645282014, -0.39231827592756296 ], [ -0.24483247566897273, -0.4836146262985731, -0.3116048521648144 ], [ 0.06099767394678907, 0.13287832249270093, 0.2981134912184014 ], [ -0.03437696368303989, 0.09634034478807658, 0.15895987197081507 ], [ -0.3767376347979977, 0.6701532023754245, -0.40328686833384675 ], [ 0.3346458124913214, -0.18673706540756685, -0.5173071617453896 ], [ -0.07047862481483512, -0.053522956560054576, -0.1300390508876614 ], [ 0.8507167867987837, 0.4145146281564014, -0.18581892369774194 ], [ 0.2565495168339516, 0.6204663349530308, -1.36855693867704 ], [ 0.260689767730986, -0.17611737199322722, 0.2633256649052019 ], [ 0.01521631550570036, -0.05708239476526758, -0.016868507784427514 ], [ 0.04952000268711603, 0.11051819085496914, -0.031547462278216934 ], [ -0.0626041005508176, 0.07915739082299496, 0.02670889917623026 ], [ 0.05809412470874584, -0.04135725751670991, -0.021459473444083926 ], [ -0.6767583719428849, -0.4102463362144235, -0.2680439002782056 ], [ -0.1997381165694276, -0.31401449207085724, -0.3535413797101537 ], [ 1.29344286808051, 1.0471227508732996, -0.29766868999801577 ], [ 0.049647529510995374, 0.13200543223651068, 0.08050439290022053 ], [ 0.21296208256254523, -0.22330409660230885, -0.21458959223019897 ], [ 1.6426179967359884, 0.6316290458109857, -0.4431330872539056 ], [ 0.14099504487787642, 0.3086712209945255, 0.39994186031233403 ], [ 0.04375532744881202, -0.2087457269480344, -0.03449472030670267 ], [ 0.078602546294907, 0.03046836937535078, -0.0277825927579241 ], [ 0.022711087513932013, -0.02409871305521593, 0.08933382568014106 ], [ 0.05663065156051756, 0.2281403457095074, 0.3683622592176153 ], [ 0.47802504333257106, -0.6734406176377659, -0.5949828245723832 ], [ 0.32127632193708344, 0.5516437590749032, 0.03935590913550665 ], [ -0.030565042935388347, 0.03753068146873352, 0.0019928637336467762 ], [ -0.1331174352874747, -0.025925483385181136, 0.0267652063827415 ], [ -0.13839257207282252, 0.01661448257879689, 0.8473836058617438 ], [ 0.895048298949841, -0.2376693762470402, 1.2346473458404277 ], [ -0.4159238509823745, -0.5633312325287002, 0.1644183285654894 ], [ -0.6225833830736407, 0.0018275416615612546, -0.929288479829849 ], [ -0.07136437059762613, 0.24642990340438076, -0.040995502998165075 ], [ -0.013033961309958672, 0.10884620106527683, -0.05288223711427368 ], [ 0.14218058154099666, 0.01655097627738923, -0.005090531423361181 ], [ 0.13139299494925138, -0.265185345383265, 0.19784218350635044 ], [ 0.4582491296521201, 0.5347246005156687, -0.3639664404517581 ], [ -0.10799619364643588, -2.3475680242932326, -2.328147694478558 ], [ -0.6984191629335363, -0.9436607014589448, 0.7516083900230358 ], [ -0.08502876693208511, 0.052197551767518245, 0.06082952365885138 ], [ -0.00531293203355399, 0.049093713425035476, 0.003993440783253996 ], [ -0.01676669201374965, 0.13857872009800123, -0.009957119573337465 ], [ 0.04816811550978217, -0.05438581950549627, 0.0022404611759770363 ], [ 1.1576607392392337, 1.0263081106435086, -2.4984456266901622 ], [ -0.5586893589837049, -2.2975399711948556, 1.9094586197243644 ], [ 0.04967041234834469, -0.008419084370824885, 0.027278141894111044 ], [ 0.6501926833329869, -0.536223040696251, -0.5434108227292569 ], [ -0.02478339840197136, 0.09458582251760754, -0.04878980877619398 ], [ 0.2881435161184632, 0.22854143813945052, -0.1650649615535067 ], [ 1.0637814564636028, 2.2635895538844277, -2.0969860429073446 ], [ -0.06748765799590686, 0.1342322665542909, 0.06537446653327715 ], [ 0.08285181205751573, -0.0331670015193782, -0.06874004339735099 ], [ 0.015272879822743621, -0.010413233657131734, -0.03111088859485579 ], [ -0.06435322350011433, -0.20195338091326723, 0.29064134493698707 ], [ 1.3777208722591117, 1.452539265743825, 2.5181585482902697 ], [ -0.06437970588491185, -0.08909728399068742, 0.04207613856422331 ], [ 0.34101264059560416, -0.6453381793780153, 1.2849304525865637 ], [ -2.900256680570244, -1.337359403832895, -2.1925864235842827 ], [ -0.18361034422773478, 0.031588085742275264, -0.08071136687849245 ], [ 0.24486384315387855, -0.05349313173834086, 0.0317032712606179 ], [ -0.06988135704896471, -0.023029133242034327, -0.11182251258388026 ], [ 2.0859621717366776, 1.1049965318561086, 3.2202777888900314 ], [ 0.45726285365131136, 0.22708927785463084, -0.563277496427509 ], [ 0.049777627440194865, 0.0901108137078898, -0.24937201922222618 ], [ -0.05027205099325934, -0.057685318962842305, -0.026822542031380806 ], [ -0.03967421197414098, -0.04405460410807727, -0.0010022168537937213 ], [ 0.06010601462176172, 0.0012906948707143357, 0.002412725232426957 ], [ -0.4651993415535445, 0.41684250691326347, 0.17928163131073346 ], [ -0.04964341574248314, -0.05793265929464054, -0.004106312306808497 ], [ -1.0023914318449594, 0.5073114755922499, 0.8584229036643317 ], [ 0.09839722904419504, 0.13270605843625102, 0.00813703411720464 ], [ -0.2969156132497444, 1.145855766272306, -0.7117937956984147 ], [ 0.39868253292652556, -1.3992289395937465, -0.2404492553191843 ], [ -0.08148167003240882, 0.15835257689419607, -1.2554643000650065 ], [ 0.10126015481817993, -0.03402960735428789, 0.04786601063466478 ], [ -0.06708630845543173, 0.02068479941112331, 0.041593542095631514 ], [ 0.12193132737110644, 0.06320136831668799, -0.06534952681167171 ], [ -0.03399849697991409, 0.019753030843101645, 0.056922729124886384 ], [ 0.07225397303839737, -0.07817651414335847, -0.07517809111900177 ], [ -0.26011332591820885, 0.15100410077868084, 0.4733014086383951 ], [ 0.05713021732422233, 0.2690975392384023, 0.7093265630332006 ], [ 0.42274679317045144, 0.36941358418302384, 0.11137205493179032 ], [ 1.8650270915763536, -0.09606266541350059, -1.2163199928973483 ], [ 0.05860011823575099, 0.07982279287984928, 0.19131414709849445 ], [ 0.0009957890904933508, 0.14102564103118617, 0.09030441793849696 ], [ -0.03413553689347799, 0.3199092652383607, 0.2498451026011334 ], [ 0.06880174992503453, 0.016594170846767717, -0.04887054148324663 ], [ 0.014339054370465835, 0.07109029077049833, -0.15853538248245863 ], [ 0.7044070101136293, 0.17847738956659112, 0.2501029844647443 ], [ -0.5610200659564192, -0.7451664856434048, 0.6822857341601392 ], [ 0.04098496146635247, -0.06724803098006905, -0.09025788093220227 ], [ -0.03750651307872414, -0.05296219848973028, 0.020701511595704273 ], [ 0.013798350921638697, 0.0028289871837589315, -0.03738695668133724 ], [ 0.5565543131258539, 0.28504944797619697, 0.5156765667513517 ], [ 0.04869082122136827, 0.014683068262301648, 0.0442687771812456 ], [ -0.0013063786131672392, 0.029589565576924163, -0.04980282427233232 ], [ 0.48048970489246506, -0.37332372115390505, 0.49543554011848584 ], [ 0.35383525704824664, 0.7151434317095036, -0.03411805337730098 ], [ -0.7617454869687836, 0.8919298053070335, 0.1738409153427681 ], [ -0.14442901314346618, 0.1205730124304722, 0.04307398453897278 ], [ 0.12766797756142084, -0.06822582233332138, 1.0402625276580804 ], [ -0.21522516946533957, -0.35210644583097905, -0.48379023279193917 ], [ 0.16063366153423148, -0.000804498854674334, 0.03250777011529224 ], [ -0.23366899347942185, -0.0024464067121208973, 0.08115333988302591 ], [ 0.08396844309805604, 0.006794660029555328, -0.07236375923556769 ], [ 0.03285846888096043, 0.02800473625758489, 0.09954985555921743 ], [ 0.045629663227199975, 0.07479165398938352, -0.3492283505356053 ], [ -0.3212220716148283, -0.8630226110820765, -0.47877734874924643 ], [ -0.1414259621295332, 1.0200520971785243, 0.6885952266157828 ], [ 0.006839911483189934, 0.016381026215727443, 0.060200888408075186 ], [ 0.05707622411249922, 0.019755859058953808, 0.016980865086917988 ], [ -0.7909115914994794, -0.589250031040049, 0.38355183522798614 ], [ -0.012024288250736521, 0.8361877277451591, -0.058289785823609115 ], [ -0.26985113020773766, 0.19404671783274785, -0.07554293096393078 ], [ -0.0055728707814209615, -0.1286640237624462, -0.05502473917755307 ], [ -0.0842507504622083, -0.11007158986085942, -0.08310069505250606 ], [ -0.17166627446298688, 0.21685010802767316, 0.010722280516613534 ], [ 0.05748425852680673, -0.05832398152436709, 0.057547250607150345 ], [ 0.16606100775453203, -0.5365444288612695, 0.8615768785605573 ], [ -0.1583824017159098, 0.6338409677179092, -0.20080178284037287 ], [ -0.04972491978113183, -0.13005190641426215, -0.06184819558669406 ], [ -1.1496864560887947, -0.3215591435222997, -0.6619529190673442 ], [ -0.028855000786957862, 0.01915653440882729, -0.01736395977962005 ], [ 0.05421252700691829, -0.03945283980607622, 0.00126472670698084 ], [ 0.11514103822059539, -0.01484633345013105, 0.007169012964168889 ], [ -0.1723401611673977, 0.5913192566017041, -0.36152209062389334 ], [ -0.1263317741265399, -0.04071448118667289, -0.006527007965727914 ], [ -0.2287913495765689, -0.5115568846968784, 0.5805049305146293 ], [ -0.49835734420430217, -0.3229789078800855, 0.1263024635258902 ], [ 0.483476043721817, 0.7521632345511238, 0.018227336946125775 ], [ 0.11553056067659781, 0.06745269096355284, 0.06796819758024254 ], [ -0.021191821380256513, 0.0045858234490161135, -0.017331306742054173 ], [ -0.017248517150745404, 0.004012981183687122, 0.07025596709411029 ], [ -0.02363771387131338, -0.10897398499968819, 0.03355292442793243 ], [ 0.03505702104021905, 0.03355266731740041, -1.0594715126154388 ], [ 1.1172735597598156, 0.078654739732906, -0.5170155984020848 ], [ -0.056926328672334596, -0.09860163191714681, -0.012625669785119156 ], [ 0.9971695169397387, 0.09076901666984771, 0.3335497502933423 ], [ 0.1412398141043545, -0.34077867001147066, -0.44707202060437246 ], [ -0.15188907522987583, -0.08871161819266522, -0.11482324960302508 ], [ 0.627310360204733, 1.3211249306204162, 1.4802730075006663 ], [ 0.4385431500363773, -0.1708160099336139, -1.4757249792998561 ], [ 0.06620904732019722, 0.4687968321174957, 1.2806361924808523 ], [ 0.18295856902907726, 0.07024851088868186, 0.015892773315431322 ], [ -0.04951280359221962, 0.008167116049450373, 0.02808289785931739 ], [ 0.06308155480876909, 0.026858794616394895, -0.0008250676972355185 ], [ -0.007752396761310488, -0.0030537017887398736, 0.01368522228755218 ], [ -0.016737895634163995, -1.2843524681105944, 0.35437133250749747 ], [ 0.16857657719976493, 0.10631494787759105, 0.7835587445049199 ], [ -0.04417364628440012, -0.06828032976610851, -0.02150189668186637 ], [ -0.06620724754647311, -0.04322799374764965, 0.00046845538933097994 ], [ -0.13173983705693937, -0.7729598770436735, -0.4853920314063915 ], [ -0.3856112905894247, -0.16984901722270623, 0.9390527665041755 ], [ -0.661170017497359, 0.7663490510445087, -0.7584441877377134 ], [ 0.5472782793518237, -0.780054327953558, -0.23944472447060247 ], [ 0.20938773194647536, 0.4569592061130019, 0.9570319917869068 ], [ 0.1100247957440327, 0.13575178979849842, 0.05924752255536428 ], [ -0.061294379500734165, 0.020406348704951272, 0.03422912512713138 ], [ 0.014578167165239608, -0.016616282352520988, 0.05397778509118877 ], [ -0.23848133130714297, -0.06955534089436995, 0.05699369163172246 ], [ 0.6603305516103308, -0.2909287945117796, -0.5053052421109383 ], [ 0.309115507993847, 0.26034549672861823, 0.5920579351601826 ], [ 0.1220691386162664, 0.020438230410921108, -0.05472931917626805 ], [ -0.8772817040770857, 0.6852605030155506, 1.194471768328858 ], [ 0.739841212304314, -1.2702584400771386, 0.7262866021670255 ], [ -0.11747380207756573, -0.06604115414279155, 0.013487504288432792 ], [ -0.14304498714963046, -0.11874829898476313, -0.05291386170971149 ], [ -0.9377921535657067, -0.4444332952143044, -0.18381448999015454 ], [ -1.2330810284793934, -0.8496122399532481, 0.031320690788979866 ], [ 0.10904751861184443, 0.06691918660962211, -0.12947597882254896 ], [ -0.41005093221009226, 0.3094155559847083, 1.0594126343036072 ], [ -0.11297308221464651, 0.22623309978302156, -1.0125755800180658 ], [ 0.03832669567585136, -0.04494523499097656, 0.014507975989999564 ], [ -0.08524268289472144, 0.05196718073083297, -0.03533470041479505 ], [ 0.11758667360112024, -0.06490369714915803, -0.0020846521935760625 ], [ -0.0011042897350036, 0.04196738080918105, 0.01716804155422477 ], [ 0.5454687354275035, 0.14615910991339384, 0.15290183361548215 ], [ -0.06899278305032154, 0.021986550034714284, -0.02401952301135537 ], [ 0.07481093727928462, 0.8048716649457553, -1.5245492408873402 ], [ 0.2575828440621191, -0.1907816711866918, 0.022505399088320166 ], [ 0.48099004198776585, -0.6098445846544351, -0.4989373855645275 ], [ -0.153541524619135, -0.12518943203279811, 0.10999394248019094 ], [ -1.1745367032290899, 0.25781347220933637, 0.24837391613694473 ], [ 0.025805926987794253, -0.12250108431005129, 0.07504902163193033 ], [ 0.01059526791379822, 0.0065493765820132015, -0.04436545074128316 ], [ 0.10718886657590938, -0.034912524921226734, 0.05731816512312515 ], [ 0.1062982356930101, 0.39908208269327655, 0.0726838618479261 ], [ 0.38752804960559506, 0.8056206279255145, 0.4971484104827685 ], [ -2.737643267939499, -1.1073421512396795, 4.1915236222183125 ], [ -0.12417744497878783, -0.0717371808690476, -0.07984284750134643 ], [ -0.01102361406013489, 0.023391659092175207, -0.021687016264917033 ], [ -1.097536212659167, -0.006413879331641398, 0.716293230008674 ], [ 1.1076460558885213, 0.5350930399080459, -2.239672360864815 ], [ 0.05839931491024742, -0.05227957002723097, -0.4458877694939123 ], [ -0.04221266425672318, -0.1109773902651476, -0.027509284262392353 ], [ 0.060208858834567634, -0.0393047441396357, 0.15149158234738092 ], [ -0.13269063180433013, 0.20966566843158335, 0.24812837557887057 ], [ -0.5056178885178684, 0.09616962339481874, 1.5243330109299158 ], [ -0.24130260517494145, -0.2731349459226308, -1.5125586341162975 ], [ 0.043638085046213276, -0.052626412134918935, -0.20356829216485223 ], [ -0.3250260219359874, -0.10249068582440281, 0.04010075834675354 ], [ 0.05471055010743097, -0.03509918716746949, -0.0035527533313806157 ], [ -0.03323102204184989, -0.014077572959406776, 0.006976180065157784 ], [ -0.006508496007422847, -0.03022951369110902, -0.0028940361483586778 ], [ 0.08315314560103708, 0.06369630609081649, -0.0060112442385062085 ], [ 0.5326090950582508, -0.7873950907531129, 0.08982413546469328 ], [ -0.23052247478862462, -0.05438376262124015, 0.27214455615330974 ], [ -0.6635014958016693, 0.8202551022972654, 0.9365775634124688 ], [ 0.044265691854861414, -0.10215129992214325, 0.11707656630560286 ], [ -0.6235490902318885, -0.16498165774113385, 0.6376269203018272 ], [ -0.030313588835077867, -0.032132131628018604, 0.08354832448874384 ], [ -0.16373132922394587, 0.018752613763032028, 0.1146499571044471 ], [ -0.0987803237368971, 0.3429620526493404, 0.05150566732586639 ], [ 0.46125115222392504, -0.2528864630843366, -0.19906654385980493 ], [ 0.2707512741803215, -0.079783197857919, -1.5946954217842801 ], [ -1.3877736369503588, -0.1974092093704375, -0.6392991672020515 ], [ 0.026056609756508694, 0.03128366687236974, -0.04556898514164448 ], [ -0.19910511043960719, -1.1953125197685461, -0.15679577262284639 ], [ 0.3063268871636144, -0.007126846836918461, -0.2890387749909387 ], [ 0.36488432505105095, -0.10788949277564973, -0.7406341411850478 ], [ 0.0017910319660151518, 0.0004728262683752317, 0.08922943880414304 ], [ -0.40907391218843603, 0.6984741845873876, -0.1644054730388887 ], [ -0.5454849333910203, -0.31451380072402996, 0.03185110981652642 ], [ 0.3431314884899382, 0.42957487756916873, -0.4881685680416193 ], [ -0.13222397618872325, 0.1985222408635296, -0.02367319512473142 ], [ -0.36143827259045647, -0.6275268472726895, -0.044311200419028036 ], [ -0.013058386810500078, 0.1433825732781659, 0.01601464370760634 ], [ 0.05172523972020703, -0.052032486805964735, 0.004625932692010424 ], [ -0.00568779918923158, 0.038525956338162845, -0.00536049748197673 ], [ 0.01764832402802843, -0.04927446212904189, 0.00875307095191212 ], [ 0.012502256729752049, 0.012828272884346825, 0.02261030018538221 ], [ -0.7850278740848525, -0.10950826068521498, 3.3871003580403913 ], [ 0.0255323613817305, -0.026197506328052806, 0.07673052451130717 ], [ -0.7374310581772072, 0.098709104119529, 1.4107312934644929 ], [ 0.5894973713718472, -0.4174444026687101, -0.3432471882293448 ], [ -0.6646883180174497, -0.6139285283449584, -0.8598902334705402 ], [ 0.23607580516961243, -0.11076784518155551, 0.10252256753037263 ], [ 0.00845250873998681, 0.004134080244266097, 0.17689204602618785 ], [ -0.047252287794745426, -0.19072022176954026, 0.06168390195673659 ], [ 0.4890016061653474, 0.4727715038319126, -0.1790008666097733 ], [ -1.0033275712920253, -0.6761821872406397, 0.08285618293655997 ], [ 0.01675897869778921, 0.037655380076760704, -0.01658028687803892 ], [ 0.07866065327514235, -0.01004505137528653, -0.05649669697333785 ], [ -0.2942619754488196, -0.10309206735878543, 0.22061497754796597 ], [ 1.0346701164762262, 0.8835305184471737, -0.6840543975098691 ], [ -0.9578046089356113, 0.19474297315344394, 0.13990232511681347 ], [ 0.6788671925264703, -2.7364065662805075, -0.41799153388083765 ], [ 0.2915828837052253, -0.061354286254693614, -0.33725214195435554 ], [ 0.02509604480890137, -0.02566940129529439, -0.07177317634352967 ], [ 0.5337825475263664, -0.27183602351489206, 1.0735614268803821 ], [ -0.025205831006071693, -0.042783449637796046, -0.04903792043958827 ], [ 0.7974144310751979, 0.5256547693883142, -0.41860165717330877 ], [ 0.6536515913201821, 0.021272296976777145, -0.30657834126392497 ], [ -0.0026991463650914535, 0.0036879934712204044, 0.01663222320550591 ], [ -0.08762686885809474, 0.016800116382911578, 0.0009543942948389669 ], [ 0.04528693488802424, -0.005259710153426926, -0.007326621720293966 ], [ -0.10779770431572046, 0.08761144222617386, 0.025384522825821983 ], [ 0.015118613503534733, -0.049236666880835715, 0.0504152615595916 ], [ 0.043610317108755674, 0.49738366661956207, 0.23815248693669608 ], [ -0.3564701257803344, 0.815267929307774, -0.06208242328135955 ], [ 0.1388016349292581, -0.7190540829014488, 0.31389519278400235 ], [ 0.17353263981488237, 0.30327601359072676, 0.2816926128702117 ], [ -0.20819551040952272, 0.21350021490605223, 0.005263566811407147 ], [ -0.15799596458629153, -0.11222360501382335, 0.005863662793129709 ], [ 0.08709516427788812, 0.12497011674898946, 0.45701088532993683 ], [ -0.9981825324358768, -0.20801321904232417, -0.9394109214752719 ], [ 0.6582577265012274, -0.3194886324079845, -1.0143930943688786 ], [ -0.17274048226574473, -0.058076384082036824, 0.07035366909627593 ], [ -0.1169294990812904, -0.6582178743687651, 0.46805352556944085 ], [ -1.2792984463827792, 2.780907514272162, -1.2275109859138247 ], [ 0.2929807936677898, 0.3666637870431254, -1.4383454788239476 ], [ -2.893988840020787, 1.55270772924307, 1.3962078908425726 ], [ 0.15057086953223592, -0.501151621466239, -0.7065929638568192 ], [ -0.015292420223176747, 0.1883995421075746, -0.06832763810399924 ], [ -0.10035126908750759, -0.8417778249322249, -0.5819254662040111 ], [ -0.6215258874554639, 0.5342664295476183, 0.7380720347335202 ], [ -0.019937893315620292, -0.2838011763432651, -0.21353389638574619 ], [ 0.18266186347513216, -0.1085433248585634, -0.09351624270442593 ], [ 0.03688122026486412, -0.03465541438921193, -0.028888168045587772 ], [ 0.02635280108938975, -0.0043266560327451875, -0.03679380268397908 ], [ -0.08092862527804497, 0.018461307530259253, 0.007072596514663335 ], [ -0.09624829921761528, -0.07819425477006747, -0.002325564762073938 ], [ 0.22057075453645947, 0.43191484052103546, -0.8825100467456067 ], [ -0.04243557908798001, 0.15474865856694453, 0.11429720145452278 ], [ 0.6972436535811647, -0.2385188694448171, 1.2133241409783115 ], [ 0.45452256960109755, 0.44912016310240244, -1.0234120176108938 ], [ -2.4563386348620972, 1.4733585339631918, -0.8585686853359841 ], [ -0.2556974525308545, 0.20999322724937025, 0.1554631687354137 ], [ -0.2601578060402474, -0.13103021198857848, 0.19182965371518412 ], [ 0.1961074587468465, -0.03536452523650877, 0.07372130284460587 ], [ 0.2116299928961765, -0.014388676703144693, 0.002592702604837323 ], [ -0.1195707955766785, -0.9477996668033191, 0.5001869427501195 ], [ 0.29255347596358117, -0.10183376841510497, -0.8241343860043048 ], [ -0.451664786037753, 1.6698061499438939, -0.7021032997467767 ], [ -1.2466127557793327, 1.9249631561364535, -0.07430828618919567 ], [ 0.17633128795586353, -0.009953777136421274, -0.024927380299899656 ], [ -0.2282946120287163, 0.2260340962312421, -0.5599399446114249 ], [ 0.6330105006995013, 0.2007099943804436, 0.16653203424918314 ], [ 0.17588005897217754, -0.43493408949848544, 0.031721268997858945 ], [ 0.0038926534547041912, 0.1602659934734503, -0.19421126857323728 ], [ -0.05521063009219977, 0.058824318619667894, -0.05523891225072141 ], [ 0.18913693511339308, -0.07403729168845206, -0.2042174962581896 ], [ -0.12842002586756418, 0.10926477701139695, -0.09866770932387461 ], [ -0.3690207192901052, 0.3012929200572965, -0.8399687952289688 ], [ -0.04258830274399681, 0.1411027741907906, -1.1455035248434458 ], [ 0.6808289458857433, 0.08168761556855268, 0.5222562823761425 ], [ -0.009836791844354535, 0.004824936243789885, -0.05988027157465272 ], [ -0.012514855145820774, 0.06570819600383238, -0.002912033885599714 ], [ -0.08043317328285243, -0.06179265971177885, 0.026149683769098053 ], [ 0.026516580498283183, 0.026290323230110154, 0.008884197323239673 ], [ -1.251822072268485, -1.3574420503780398, 1.3428862518290856 ], [ -0.017129732084954562, -0.04000022812873575, -0.02483070673986209 ], [ -0.07818088502240271, 0.011305150092691105, 0.016320862351235976 ], [ 1.6171686820560984, 2.7036118608114865, -4.8864489101323 ], [ -0.394055314681855, -0.6828804308206895, 1.419050618948896 ], [ -0.32806738241919053, -0.15900126676646945, -0.5182582136033124 ], [ 0.14479693831477936, 0.0078058757519695685, 1.1674275970188803 ], [ -0.03074707719205483, 0.1095177737748995, -0.44494828760993016 ], [ -0.053184084878859055, -0.18996740213180088, -0.05153497792651608 ], [ -0.027216949587491518, -0.20687010561698635, -0.29481964819275974 ], [ 0.328352517999195, 0.1423057943700879, 0.1691054535641194 ], [ -0.6923714089994841, -0.046026384778098825, -0.13448114954928125 ], [ 0.11420078500501722, -0.10658028594663033, -0.031428420101894075 ], [ 0.7541126466048599, -0.7383669405137412, -0.2976766604245082 ], [ 0.6766046198447401, 0.26480302202215894, -0.4708624581317026 ], [ 0.01412848084474571, 0.0008587491769294583, 0.3571794937381632 ], [ 0.0555983527744781, -0.27223531617111096, 0.40025579227192415 ], [ 0.5462315823759915, -1.0177100773424015, -0.14195483849388768 ], [ 0.39631248804241304, -0.3499163783192769, 0.1218937892334323 ], [ -0.25904503165768733, -0.08521388651513577, 0.2082042521676112 ], [ -0.006634223057578089, 0.024176360435884402, 0.033913650504349205 ], [ -0.4647527405594348, -0.16343590922266085, 0.2204152026645905 ], [ 0.35692392586934046, -0.6550428164089143, 0.06854798182993592 ], [ -0.11340708479268752, -0.0025415376089663764, -0.024930722736815847 ], [ -0.08402886407307952, 0.005993503611797187, -0.09431997022750423 ], [ -0.040867719063753714, 0.0287688687587329, -0.012964027245250644 ], [ -0.25961350304397207, 0.029196957794537553, 0.06685773719247058 ], [ -0.02709019409520822, -0.14659156982824273, -0.01639336752126415 ], [ -0.09613928435204101, 0.1393955602582123, 0.026395738548236222 ], [ 1.978086820040289, -0.018174886397594753, -2.7117730633187005 ], [ -0.35394967123499316, -0.6016730977259405, 0.2613009194655852 ], [ 0.01443109994092714, -0.20836083248160825, -0.25104555167511056 ], [ -0.04600015950383331, -0.0015904857510436016, 0.05849958801773319 ], [ 0.06342171204262467, 0.08130400665478658, 0.19001651024341573 ], [ -0.22571167962409552, 0.010783729933765073, 0.1536124871259711 ], [ -0.27485115872382965, 0.17171486835353766, -0.1769087582107688 ], [ 0.4591955535204667, -0.34072519102081156, 1.323289544189449 ], [ 0.9380551776399578, -1.9431750664506582, 0.1001224407140144 ], [ 0.11431931296027606, 0.10779641876306038, -0.22574818931964163 ], [ 0.14969720794444957, -0.11489935432050145, -0.18127346660225216 ], [ -0.6109375615260301, -0.8194426330160987, -0.4223143332556025 ], [ -0.04126598327784465, -0.07426791983566934, 0.027247545740801286 ], [ 0.7327665589053947, 0.33434319339514, 1.1863879560917803 ], [ 0.11458336547665526, -0.1690175217621703, 0.24516157714995174 ], [ -0.8586471040482485, 0.7726996811852745, -0.13247054518892545 ], [ 0.12084297848908776, 0.11012146930407028, -0.0714229917989255 ], [ -0.821202297497208, -0.02110543224149954, 0.1583057827773694 ], [ -0.40978353725679684, 0.8070077392457344, 0.08660099783535566 ], [ -0.005552559049391792, 0.05568911279227934, 0.06771185837982376 ], [ -0.045870832906229855, -0.044245123012300235, -0.09969615145193385 ], [ -0.4117208651155285, 0.17780941640441666, 0.3755215019815676 ], [ -0.06606172298535272, 0.00850007418840955, 0.017911605212811592 ], [ 0.03580032758827387, -0.005730222427014024, 0.0035026167776377277 ], [ 0.005355612381868448, 0.021957239434064597, -0.007779650477704057 ], [ -0.016480013770553144, 0.05008564585754861, 0.01047982528492357 ], [ -0.0434928175956249, -0.06838214553678637, 0.030207916406419778 ], [ 0.06001088372491624, 0.13140147959680787, -0.011701100311993909 ], [ -0.27424283520508264, -0.28381171787507775, 0.8031755067660536 ], [ -0.9832061010565463, 0.9820002526613967, 0.6403486923937359 ], [ -0.34042771413527045, -0.31304801358101353, -0.13917753052706372 ], [ -0.46747682664613166, -0.15476691341471757, -0.05106189454760884 ], [ -0.7383720827243815, -0.2697850528010099, -0.7466333012285493 ], [ -0.04271608667840817, 0.2213027482211056, 0.139928550391079 ], [ 0.09645964407493145, -0.048968500595944264, 0.06782961500348654 ], [ 0.075963563794307, 0.05160876864920433, -0.27830852404783274 ], [ 0.8801196901294651, -0.22280761616498826, 0.9555194105270637 ], [ 0.8514984028161088, -1.3281116522173864, -1.8616041790636402 ], [ 0.032821959185414334, -0.0584893035964526, 0.021558203888377613 ], [ 2.2560045360794594, -1.2414728591338247, -0.44811383248009645 ], [ 1.8599604714324698, -3.5354896447084814, 1.3497433897179205 ], [ -0.6631664807784541, 0.34972637363611797, -0.3525641025779654 ], [ -0.08591117027795993, 0.06718915266823766, -0.00936319424438326 ], [ 0.10658105727822638, -0.08700928936019517, -0.10930077248587901 ], [ 0.18584489186147546, -0.2395419122517041, -0.06090537126579576 ], [ 0.5899012920176425, -0.5960372348641759, 0.23812883276775065 ], [ 1.084983048044076, 0.0026135285579305225, -1.1635583406225896 ], [ -3.081725036955764, -3.672163432874785, 0.6329292537713846 ], [ 0.8830615488367786, -0.9446948000187082, -0.20787437935503622 ], [ -0.49599501263615003, 0.5769943433104991, -0.1916098242103115 ], [ -0.8002902123757836, 0.9309836095674227, -0.10309540979570163 ], [ -1.2698835729214613, 0.46997619812784763, -0.09843888095038145 ], [ 1.4284513513309536, -0.4184869858760301, 0.8505509505056343 ], [ 3.7437761722463376, 2.230876609564588, -0.05991703838073083 ], [ 0.2390089221188374, -0.27834657640657096, -0.6769558328314723 ], [ 0.32930511252030986, 1.6675155522141738, 2.5188576318268177 ], [ -0.005610408919095124, 1.1488688445969875, 0.10508004599232393 ], [ 0.3888477979664271, -0.5345078563371802, -0.018299070784557905 ], [ 0.3187468685231218, 0.008769526025961068, 0.6700336459780376 ], [ -0.41922463599238063, -0.3506411729090267, -0.8185208917588255 ], [ 1.1908328829692523, -1.315999689275233, -1.0808422829259774 ], [ 0.6050289043897978, -0.10889530917689165, -0.9280733754555471 ], [ 1.2400471812338028, 0.9697301667420543, -2.980009025164321 ], [ -0.600292928390085, -0.581855017918239, 2.0549574697915447 ], [ -1.5104757816964456, -0.5890456281670973, 3.1139787818654248 ], [ 0.7004541927944335, -0.5034987835130024, 0.7144980842741465 ], [ -1.0148486942316088, -0.10840268539755128, 0.31759912710820765 ], [ -0.2753273274291211, -1.1106547633341586, 0.1803139300967729 ], [ -0.4670862757480011, -0.44914947370305214, -0.34247611374383247 ], [ -1.0596553466458292, 0.7098865497719288, -1.0184518412272643 ], [ -0.9742373143682738, -0.16161993753504025, 1.0101520561432942 ], [ 1.4614445461306897, -0.5230003602557934, -0.2554477982042681 ], [ 0.056041354221139615, 0.06750334173835976, -0.19429791482252629 ], [ 0.1795112310158227, 1.5033255378011139, 0.7803281506701538 ], [ -0.10269843113427077, 0.9387630029345947, 0.0021425020632793944 ], [ -0.5790185745290517, 0.5986376507849737, 0.6173910358796016 ], [ 1.5126967024719897, -2.1977746570098096, -0.1580003354653358 ], [ 0.7250247036758968, 0.655820061547195, -1.7294887035194275 ], [ -0.2602601360319893, 0.7210688010303169, 0.5110002403950663 ], [ -1.3770369582439526, -0.9488211669470139, 0.28195615116552686 ], [ -1.0746490044308048, 0.9265553948745315, 0.15472706128225527 ], [ 0.5124153767632758, 1.3238575013546696, -1.7199218777336882 ], [ -1.369733990692604, 2.444875876013281, 0.8948446674084851 ], [ -0.12107592063109318, 1.2314437486115233, -0.5331721671233632 ], [ -0.11675260703526419, 0.5612370672454396, 0.35062060406646545 ], [ 0.011775662366278201, 0.010531761612390562, 0.08340382836975152 ] ]
[ [ -38.03997471582835, 51.44757560330967, -8.034485941965954 ], [ 51.44757560330967, 11.082049575125454, 11.862830340645655 ], [ -8.034485941965954, 11.862830340645655, 7.228518700138647 ] ]
true
null
null
null
null
null
5.81396
0.759295
null
CO_9374583315519276951260569
9374583315519276951260569308834000645857928643208032900744491446171102417056708907311489087773773608845334078199008175214946150802126853923959448381855481
1445403285700739570253041087942913424146853756131054796241407154109221050289149680077448481321373035457933876640188568945705028036970127337193100898070645
[ [ 16.2899730972, 0, 0 ], [ 0, 16.2899730972, 0 ], [ 0, 0, 34.45765881336805 ] ]
[ [ 15.865098018878829, 0.562440643132405, 0.1399943998000271 ], [ 16.289940517253807, 2.7149683662448383, 2.7149781402286965 ], [ 2.7149846562179354, 0.000021176965026360002, 2.7149911722071742 ], [ 3.3220305036850934, 2.3421560419423186, -0.016130331360847443 ], [ 1.4493449704148396, 1.4475937983068905, 1.3088635004192062 ], [ 0.00000651598923888, 0.00000488699192916, 5.429975828425109 ], [ 0, 2.7150009461910325, 8.144999580578478 ], [ 2.7150009461910325, 0, 8.144999580578478 ], [ 2.7150009461910325, 2.7149846562179354, 5.429975828425109 ], [ 1.3574972151008968, 1.3574972151008968, 6.787471414528697 ], [ 0.00002769295426524, 16.289956807226904, 10.85995328584753 ], [ 0.06585710323736016, 2.629641487161704, 13.733274851572938 ], [ 2.5745813780931686, 16.249997503219472, 13.65994879567051 ], [ 2.714952076271741, 2.715033526137227, 10.859849030019708 ], [ 1.3573440893537831, 1.3575346820390204, 12.217344616123295 ], [ 3.5018066467857922, 2.4686965529613683, 18.035003885291356 ], [ 0.9629866466329072, 3.900959857586484, 24.89176958738092 ], [ 3.602837059934627, 3.814346070628672, 22.40192702034208 ], [ 3.981481194605944, 1.5039685082043706, 21.71663228710252 ], [ 0.39911411486525833, 1.057712840193125, 19.89685495745466 ], [ 2.7640174752405073, 0.9841489506834797, 19.723912458068238 ], [ 3.7556858775056545, 0.9339790915387232, 25.47537905055314 ], [ 1.4854533247820931, 1.7335952269771213, 25.74108154374695 ], [ 0.9666013916631758, 2.1458129962017676, 27.96036231861709 ], [ 2.3933554273868185, 3.330305810018471, 29.352348664759376 ], [ 1.188720061835427, 3.080254722976451, 31.589649407869636 ], [ 0.9689096808510491, 0.7821940092109427, 32.62589532151527 ], [ 0.8733738756279003, 0.15061057526747232, 29.085989685649746 ], [ 1.3574760381358706, 4.072460694353806, 4.072481871318832 ], [ 0.00692160956900028, 5.268470519150229, 0.00803584372884876 ], [ 2.7150009461910325, 5.429953022462773, 2.7149911722071742 ], [ 1.240370679534719, 6.812010630002319, 1.3299687895639387 ], [ 16.2899730972, 5.429985602408967, 5.429975828425109 ], [ 2.7150009461910325, 5.429985602408967, 8.144999580578478 ], [ 1.3574988440982065, 6.787494220491033, 6.787471414528697 ], [ 1.357490699111658, 4.0724932743, 9.502493537684755 ], [ 0.9396545181657876, 4.575706833245605, 14.970029157080079 ], [ 0.00000977398385832, 5.429985602408967, 10.859987494791033 ], [ 2.8467053786818943, 5.408515417866858, 13.696163034862897 ], [ 1.3575200210632328, 6.787494220491033, 12.217515660840814 ], [ 1.6077128308711985, 4.102173605283099, 17.462180013306796 ], [ 1.2737634953866694, 4.1427193483220295, 22.600161331959217 ], [ 0.8531352130519391, 6.310882187613156, 21.795609334672363 ], [ 1.968154549603704, 6.025872818304544, 19.744344971324054 ], [ 0.9887150301426249, 8.040632980939337, 18.797447931119255 ], [ 1.9868554387192896, 7.690984998381036, 25.200440142613214 ], [ 2.4582709701791607, 5.434644534714767, 25.7536932409188 ], [ 1.0871309026093585, 6.984635474913348, 31.843153969208267 ], [ 1.8759533018735521, 5.021270177400219, 32.87188857625878 ], [ 0.9390648211396689, 6.561242784144023, 29.43993985010302 ], [ 2.4666765962973156, 5.368947073213759, 28.167934042813542 ], [ 16.289956807226904, 8.145002838573099, 2.715046558115705 ], [ 3.010044938927519, 7.927938947052907, 0.1607494545231696 ], [ 1.3575232790578524, 9.50246258673587, 4.072481871318832 ], [ 15.932571087447434, 11.383302880538583, 34.33716676935999 ], [ 2.7149846562179354, 10.859987494791033, 2.71501560716682 ], [ 0, 8.1449865486, 8.144999580578478 ], [ 2.7150009461910325, 8.1449865486, 5.429975828425109 ], [ 16.2899730972, 10.859971204817935, 5.429975828425109 ], [ 2.7150009461910325, 10.859987494791033, 8.144999580578478 ], [ 1.3574972151008968, 9.502478876708969, 9.502527746628258 ], [ 16.28177924073211, 8.06568695956283, 13.574941200060083 ], [ 2.7149683662448383, 8.145019128546194, 10.859987494791033 ], [ 0.860895756235445, 9.753849451571861, 14.82027543439752 ], [ 16.289956807226904, 10.859971204817935, 10.85995328584753 ], [ 2.6222947092948674, 10.82090784933085, 13.591550456629989 ], [ 1.686158825318075, 9.408062192637596, 16.989352141179396 ], [ 0.6756917940987589, 10.384303990379696, 22.551921834626476 ], [ 1.8089200625785742, 8.26670522758228, 22.87620144208051 ], [ 2.2576599514871423, 12.052511265344656, 23.51301395738818 ], [ 3.9910434088140003, 8.940393354990082, 22.056178857343244 ], [ 2.097659835726444, 11.552686020803268, 19.86363807331216 ], [ 0.13501781301883248, 10.050457281725679, 20.22551168067991 ], [ 1.8958922289445248, 11.696591643143933, 17.546083148741236 ], [ 4.062996219984333, 8.678597197344981, 25.80875660798196 ], [ 1.5810086779729586, 11.719169545856653, 25.802587595170046 ], [ 1.6464275809340039, 11.987497982713732, 30.106005899098644 ], [ 3.9733199180842464, 9.2113933474351, 30.631450384329998 ], [ 2.483324948802654, 9.002295252759442, 32.47462663133468 ], [ 1.5891292295619128, 11.328487121066505, 32.71310695048575 ], [ 2.3983727391007563, 10.012469064463009, 29.048017758360178 ], [ 0.037121590693899364, 8.5103543551971, 26.396568884213252 ], [ 3.2880821997505287, 10.551439114356969, 26.956919523797286 ], [ 0.47924286353307544, 8.700165121725673, 28.689623689245987 ], [ 16.289956807226904, 13.574923281089676, 2.7149911722071742 ], [ 2.6133189341183103, 13.345088050661282, 33.84886668078487 ], [ 1.3984290305022313, 12.411786622003403, 1.2096086943379665 ], [ 1.3574841831224191, 14.932497059064131, 4.072481871318832 ], [ 0, 13.574972151008968, 8.144999580578478 ], [ 2.7149846562179354, 13.574972151008968, 5.429975828425109 ], [ 1.3574972151008968, 12.2174798229, 6.7875056234722 ], [ 2.8305945952887637, 14.88799285256258, 16.615003672413813 ], [ 0.0165831926129496, 13.164953528152443, 16.736811946248125 ], [ 1.3574923281089677, 14.932464479117936, 9.502493537684755 ], [ 16.216179519069684, 13.524913063681273, 13.538415822381541 ], [ 2.7150009461910325, 13.574988440982066, 10.85995328584753 ], [ 1.3574402001950565, 12.2174798229, 12.21748145189731 ], [ 0.869232964466592, 15.16811522994203, 14.88443675143546 ], [ 2.0909483668103976, 14.379827141795426, 22.82658381302375 ], [ 3.7418231103999373, 16.078936495725774, 23.332214803976974 ], [ 0.3663696399425766, 14.805956548045081, 24.28514239222236 ], [ 1.845979751374704, 13.857407704568221, 20.525535518192214 ], [ 3.180128548035384, 15.037323035944613, 18.980074819511966 ], [ 1.5366885481674064, 14.029511270340139, 26.229484259152578 ], [ 2.9825474643394454, 15.810901278384446, 30.050012374571637 ], [ 2.8934738914439557, 15.567724559989445, 32.680165366888595 ], [ 3.325565427847186, 13.576226478937452, 29.482873703198003 ], [ 3.74128554128773, 13.95794941852414, 27.141165635515854 ], [ 4.0724932743, 1.3575151340713039, 4.072481871318832 ], [ 4.784593158271001, 0.3743175178167005, 34.220079329729245 ], [ 5.429985602408967, 2.71501723616413, 2.714963479252909 ], [ 6.775667700022465, 1.2995163138560328, 1.2713216284193989 ], [ 5.430001892382065, 0.00000488699192916, 5.429975828425109 ], [ 5.429985602408967, 2.7150009461910325, 8.144999580578478 ], [ 6.787494220491033, 1.3574988440982065, 6.787471414528697 ], [ 4.257074959464373, 0.6689102782983944, 16.573275277328026 ], [ 4.0724932743, 1.3574955861035871, 9.502459328741251 ], [ 3.6631914102597527, 1.680538784599541, 14.604742800348467 ], [ 5.43003447232826, 16.289940517253807, 10.85995328584753 ], [ 5.4449235077391, 2.556466928009082, 13.580178426410832 ], [ 6.787526800437227, 1.3575118760766842, 12.217413034010303 ], [ 5.178566157626783, 3.9623893461360256, 18.931385718921742 ], [ 7.628382631768497, 1.1625127531166517, 23.19796750668564 ], [ 6.3015480330284595, 1.171610703091438, 21.278089921352798 ], [ 7.064228283466266, 2.8358888365453536, 19.824115340583734 ], [ 7.35062230048814, 2.3864810587398, 25.188105374984016 ], [ 5.1279043412944905, 2.882005750383527, 25.83032616135996 ], [ 4.647366424900188, 2.6768172492511955, 29.558369583516978 ], [ 7.185165043739879, 0.3705252120796724, 30.185121411439816 ], [ 7.307698221377018, 2.1562548689570726, 31.998144918241575 ], [ 4.950099284938553, 3.0365650151297605, 31.90931406594523 ], [ 5.003400076912591, 0.4517193249880463, 29.184400671124553 ], [ 5.7260884433967725, 3.940935451567013, 27.962188424601283 ], [ 4.109504093176839, 4.115352193518733, 1.3053318342517333 ], [ 6.787494220491033, 4.072460694353806, 4.072481871318832 ], [ 4.072476984326903, 6.78751051046413, 4.072517709259646 ], [ 4.689850674737686, 6.083962862369159, 0.04757812442499204 ], [ 6.73567581606884, 6.889306552348533, 1.2126060493878514 ], [ 4.0724932743, 4.0724932743, 6.787471414528697 ], [ 5.429985602408967, 5.429985602408967, 5.430011666365923 ], [ 6.787494220491033, 6.787494220491033, 6.7875056234722 ], [ 8.1798959609473, 6.174355923085521, 16.9918331040821 ], [ 6.787494220491033, 4.0724932743, 9.502493537684755 ], [ 4.0724932743, 6.787494220491033, 9.502493537684755 ], [ 4.072476984326903, 4.07260730411168, 12.21748145189731 ], [ 7.12412651454467, 3.332293186736329, 14.961621901964614 ], [ 4.285810472007834, 6.572287385903923, 15.226808003011243 ], [ 5.430001892382065, 5.429953022462773, 10.860021703734537 ], [ 6.787543090410324, 6.787477930517936, 12.21748145189731 ], [ 4.086877320544828, 5.259950863220394, 20.590280016267034 ], [ 8.07638947188769, 4.661603861387141, 20.912666728847167 ], [ 7.282432473103261, 6.8588443026567685, 21.384219096081058 ], [ 7.167408973063932, 7.698592415817428, 23.59288695347837 ], [ 4.397820327024181, 4.693076089410932, 24.51559501263114 ], [ 5.0901767636013755, 7.346468357348354, 20.699235501327653 ], [ 4.859347844814051, 7.692288196228812, 18.370277595588686 ], [ 5.71725927797809, 5.660667911438417, 17.09964992002323 ], [ 6.328752288100784, 6.002056877636437, 24.96306102564351 ], [ 8.059822569247839, 4.55334070018315, 25.560143925564418 ], [ 5.061131741569069, 6.982224558894961, 30.568703036956894 ], [ 4.30910513353683, 5.260113762951367, 32.357332309045596 ], [ 7.387225870037549, 7.202953694362021, 30.402307477758235 ], [ 5.599466482512237, 7.2333670741344935, 26.847551902417305 ], [ 7.980913939565002, 4.743575006012252, 27.878110986454704 ], [ 7.651758743162978, 7.189889135938067, 28.05070976740878 ], [ 4.632493679462445, 5.962146443548297, 28.488976832613154 ], [ 4.204930755580237, 9.639966249649335, 1.2164065001114284 ], [ 5.429985602408967, 8.1449865486, 2.715033526137227 ], [ 6.787461640544838, 9.502511456655164, 4.072481871318832 ], [ 6.053451742758103, 10.388197293949926, 34.23317321010477 ], [ 4.0724932743, 9.502478876708969, 6.7875056234722 ], [ 5.429985602408967, 8.1449865486, 8.144999580578478 ], [ 5.429985602408967, 10.859987494791033, 5.430011666365923 ], [ 8.453095099760441, 12.709111210973496, 17.200198149968386 ], [ 6.787494220491033, 9.502495166682065, 9.502493537684755 ], [ 4.072509564273097, 9.502446296762775, 12.217447242953806 ], [ 5.448132632439249, 8.13364872732435, 13.715632810708671 ], [ 6.143698193716591, 9.87678987853643, 15.181116257470906 ], [ 5.430001892382065, 10.859971204817935, 10.85995328584753 ], [ 5.400012051910119, 9.235355897861082, 23.949489125551867 ], [ 5.984447416718364, 11.46191829070567, 24.570554123866476 ], [ 4.2352463955141255, 11.021144198641633, 20.920316500213616 ], [ 6.238733896765656, 10.968185496102636, 19.63680345592827 ], [ 6.266247661326827, 9.423830886595686, 17.765062741097655 ], [ 5.055902660204867, 12.02939579351973, 26.69218139701083 ], [ 7.69038226937644, 8.643736654916973, 0.059174956272888726 ], [ 5.722488359342291, 10.796081930330717, 31.737611233511505 ], [ 4.072525854246194, 12.217463532926903, 4.072481871318832 ], [ 4.09337701981061, 14.979672821153622, 1.25979647245313 ], [ 5.43003447232826, 13.574972151008968, 2.714981398223316 ], [ 6.855944687445467, 12.09717837157718, 1.0907440186423176 ], [ 6.78751051046413, 14.932464479117936, 4.072481871318832 ], [ 4.0724932743, 14.932480769091033, 6.7875056234722 ], [ 5.429985602408967, 13.574972151008968, 8.144999580578478 ], [ 6.787494220491033, 12.2174798229, 6.7875056234722 ], [ 6.334665548335067, 15.972074272208143, 16.695497316479006 ], [ 3.873413513079119, 12.691273690432062, 16.623549392300607 ], [ 4.0724932743, 12.2174798229, 9.502493537684755 ], [ 6.787494220491033, 14.932480769091033, 9.502493537684755 ], [ 4.49266055039608, 11.662545599370784, 14.740679367849982 ], [ 4.072509564273097, 14.932399319225548, 12.217344616123295 ], [ 5.400403011264452, 13.410215363103887, 13.555404635324612 ], [ 6.7875593803834215, 12.217463532926903, 12.21748145189731 ], [ 7.008386255689065, 14.466017389452713, 14.770485131625927 ], [ 5.4276561362560685, 14.554292753666438, 22.700193169757192 ], [ 4.586686275113118, 12.329766607459002, 22.880233210422066 ], [ 7.346908186621978, 15.210436580048556, 23.927746898459034 ], [ 6.62979099093704, 15.14030824586511, 20.745375221128164 ], [ 5.525102755323518, 14.794520986930845, 18.727155068207527 ], [ 6.0005419101383985, 12.617952521521566, 17.89272726026041 ], [ 7.265230261512617, 15.403326151492502, 26.236720265202354 ], [ 7.011937469824255, 14.563757228035913, 31.256719824700994 ], [ 5.53166761448169, 13.083145283258306, 30.181089643098257 ], [ 5.034236995985591, 15.910742523497186, 26.99947544951641 ], [ 6.76389004947319, 12.223311633268798, 28.340257523222267 ], [ 8.145051708492389, 16.2899730972, 2.71495696326367 ], [ 8.570904185199392, 2.1022536081398546, 34.28093052423384 ], [ 9.502478876708969, 1.3574760381358706, 4.072517709259646 ], [ 10.493772609592881, 0.12165026109527016, 34.3366487482155 ], [ 10.860052654683422, 2.7149846562179354, 2.715046558115705 ], [ 8.1449865486, 0, 8.144999580578478 ], [ 8.1449865486, 2.7150009461910325, 5.429975828425109 ], [ 10.859987494791033, 16.2899730972, 5.429941619481606 ], [ 10.859987494791033, 2.7150009461910325, 8.144999580578478 ], [ 8.51419878884804, 0.40666777539043, 16.96164778393299 ], [ 9.502478876708969, 1.3574890701143483, 9.502493537684755 ], [ 8.096279529039373, 16.19961261642983, 13.703157949310835 ], [ 8.144970258626904, 2.7150009461910325, 10.859987494791033 ], [ 8.923435492995898, 1.7360550129147985, 15.00586546889661 ], [ 10.859971204817935, 0.00000162899730972, 10.85995328584753 ], [ 10.90858048453998, 2.685678994616073, 13.736031115020984 ], [ 9.797848668907399, 1.6665782776552405, 22.420637683441523 ], [ 11.427025168331468, 0.38327211602823136, 23.537444030042053 ], [ 9.829451216715967, 4.04928006263649, 22.392071586618272 ], [ 10.26291111085936, 0.7904432515873647, 20.303731244500735 ], [ 8.935490073087825, 1.8413859789612936, 18.67116154368052 ], [ 10.811785464396417, 3.5159952133534538, 17.89441653047059 ], [ 11.620794398322662, 3.5238469803863044, 25.679091680122863 ], [ 11.103685492325145, 1.1853170864554219, 25.754382306780812 ], [ 9.246042120212845, 3.4898172265862533, 31.25820221225284 ], [ 10.980305236086952, 2.9889657137397423, 32.795702001080485 ], [ 9.564445934370717, 3.307841937117432, 28.995539610027546 ], [ 8.754720241628196, 0.9317978641410081, 26.434369766785302 ], [ 11.635357634271559, 3.9843156499248567, 28.077966150395014 ], [ 9.044518863027385, 0.9777046373262274, 28.756609687618983 ], [ 9.488534659737764, 4.023134655815484, 1.1077409765719362 ], [ 8.1449865486, 5.430001892382065, 2.7149406732905725 ], [ 9.502495166682065, 6.78751051046413, 4.07255191820315 ], [ 10.712921617669512, 5.787550511892508, 0.11888748165798504 ], [ 9.502478876708969, 4.0724932743, 6.787471414528697 ], [ 8.1449865486, 5.429985602408967, 8.144999580578478 ], [ 10.859987494791033, 5.430001892382065, 5.430011666365923 ], [ 9.502478876708969, 6.787477930517936, 9.502493537684755 ], [ 9.502430006789677, 4.072558434192389, 12.217551498781628 ], [ 8.031836395466849, 5.1713985694640145, 13.580419518012672 ], [ 9.743994017848054, 5.972506866438117, 14.953283064736157 ], [ 10.859987494791033, 5.429969312435871, 10.85995328584753 ], [ 12.338530612985293, 8.26867631432704, 18.846482379139136 ], [ 10.090074496298069, 4.910758999908815, 24.56686770295458 ], [ 11.670038986995497, 5.094314416768064, 21.42126249490409 ], [ 9.040055410398752, 7.997985831370868, 20.318237465543792 ], [ 10.862756790217556, 6.641747831190385, 19.87959084396625 ], [ 9.321220346056423, 5.162406504314361, 18.93617497101232 ], [ 8.533437247075833, 8.342877141784786, 18.04137815176429 ], [ 10.77633848293691, 7.131277812734342, 24.937011729663773 ], [ 10.986267366240527, 6.677878991519974, 31.109310229147123 ], [ 8.781598697238577, 5.777059769217911, 31.598745728847113 ], [ 11.63970705708851, 6.204834462750383, 28.940992635111574 ], [ 10.80043135314767, 7.653469190338185, 27.29477682382783 ], [ 9.16991907592963, 7.114140761036087, 33.43361734756684 ], [ 9.564950923536731, 9.617844466183339, 1.3556890280871077 ], [ 10.859987494791033, 8.144970258626904, 2.71495696326367 ], [ 8.145002838573099, 10.859987494791033, 2.7149781402286965 ], [ 10.665029096763744, 11.326239104779091, 0.12273680230085342 ], [ 8.1449865486, 8.1449865486, 5.429975828425109 ], [ 9.502478876708969, 9.502478876708969, 6.787471414528697 ], [ 10.859987494791033, 8.1449865486, 8.144999580578478 ], [ 8.1449865486, 10.859987494791033, 8.144999580578478 ], [ 10.859987494791033, 10.859987494791033, 5.429941619481606 ], [ 10.570482092907595, 9.369373506531746, 17.44260761063051 ], [ 8.1449865486, 8.1449865486, 10.859987494791033 ], [ 9.502495166682065, 9.502478876708969, 12.217515660840814 ], [ 10.628034567860002, 7.937598901099547, 13.683724011405875 ], [ 8.04097507037438, 10.886963690239996, 13.833891499405103 ], [ 10.859971204817935, 10.859971204817935, 10.85995328584753 ], [ 9.321578725464562, 8.671576218940087, 23.809108653389437 ], [ 9.835038677488305, 9.721139185592683, 21.670355731527994 ], [ 8.504457384935911, 11.328438251147213, 20.42722715954792 ], [ 10.026168931837752, 11.486418410243859, 18.360938554012066 ], [ 8.246228731399098, 12.1436047949042, 25.000793490328554 ], [ 9.469638290945012, 10.235250736540316, 25.514970201168573 ], [ 11.819027080942488, 10.73357730355676, 25.652146435622782 ], [ 11.584190828773252, 10.930180988866868, 30.94594623394185 ], [ 7.829303159949362, 9.434875488355589, 31.09948900436682 ], [ 10.108579905736487, 8.729193853784883, 31.79053735610431 ], [ 8.329144694463846, 10.669557709284765, 29.227784127477015 ], [ 9.00713337476931, 9.11726988287948, 27.56375360161418 ], [ 8.794239716362004, 12.955806563557493, 0.023830601643893883 ], [ 9.502478876708969, 12.217496112873098, 4.072481871318832 ], [ 9.390110642284483, 14.83755909585365, 1.3596165406008425 ], [ 10.859987494791033, 13.574972151008968, 2.7150058331829614 ], [ 8.1449865486, 13.574988440982066, 5.429975828425109 ], [ 9.502478876708969, 14.932480769091033, 6.787471414528697 ], [ 10.859987494791033, 13.574972151008968, 8.144999580578478 ], [ 9.502478876708969, 12.2174798229, 9.502493537684755 ], [ 8.144970258626904, 13.575004730955163, 10.859987494791033 ], [ 8.848257267152318, 12.771957927182495, 14.877751346476371 ], [ 9.502446296762775, 14.932480769091033, 12.21748145189731 ], [ 10.746413802357354, 13.560474074952461, 13.560296514245701 ], [ 9.67780785715413, 14.711784213570168, 17.781843042385084 ], [ 11.338570614413673, 14.312728742608058, 23.52941633129975 ], [ 9.053657537934914, 13.678820729503618, 23.40516130350624 ], [ 8.56486060518033, 13.66135787834342, 21.05373626687161 ], [ 10.468050742072402, 14.77669975636251, 20.239226209030445 ], [ 12.2058487821086, 12.42499779018523, 17.84562480304986 ], [ 8.306469051912543, 13.450011767380348, 27.02803991734235 ], [ 9.86212890274895, 12.30195962338208, 30.064002203467513 ], [ 12.344851122547007, 15.609638660768539, 31.022614992323824 ], [ 8.935946192334546, 13.493896954904203, 32.04710931937714 ], [ 10.904850080700722, 14.693018164562192, 32.690434565929074 ], [ 10.979604767243773, 15.841998837027, 29.080786668242503 ], [ 10.475707029428085, 13.634756352275692, 28.177031992788326 ], [ 13.574972151008968, 0.000021176965026360002, 2.7150400421264655 ], [ 14.00012415887279, 1.9556275602919573, 34.3427819230866 ], [ 12.17431139419242, 1.2751383691160731, 1.3267743258395777 ], [ 14.932497059064131, 1.3575102470793745, 4.072481871318832 ], [ 13.574972151008968, 16.2899730972, 8.144999580578478 ], [ 13.574988440982066, 2.7149846562179354, 5.429975828425109 ], [ 12.2174798229, 1.3574988440982065, 6.787471414528697 ], [ 14.932464479117936, 1.3574923281089677, 9.502493537684755 ], [ 13.651567604512001, 16.202235302098483, 13.724660713799139 ], [ 13.574972151008968, 2.7150009461910325, 10.85995328584753 ], [ 12.217496112873098, 1.3574646351547024, 12.21748145189731 ], [ 15.494810640406378, 0.6673855368164966, 15.044733344706529 ], [ 14.958202636611512, 1.2207510359364515, 17.193892301382462 ], [ 13.36906689106036, 0.5517267278263766, 22.173196250089674 ], [ 14.737750430687104, 2.048252347322636, 23.283009311239574 ], [ 13.603300414225, 3.8752542800391026, 24.33169424834223 ], [ 15.98064279805727, 2.8169110178871155, 21.409235607766426 ], [ 12.570125160508185, 1.3132894861097153, 20.024209967128574 ], [ 12.511888506685697, 3.619615732224743, 19.806712762323997 ], [ 15.993805096319807, 2.9935594861531527, 18.368897834867354 ], [ 13.493620025361553, 16.013027264574504, 18.346157032423665 ], [ 15.802414202400804, 0.641039763326395, 24.928570265604808 ], [ 14.13050910354278, 2.0706673503043835, 30.887919720772313 ], [ 12.574572323163721, 1.3172267726073086, 32.42448935213611 ], [ 15.744535927986453, 0.3214239751700921, 30.942500904631792 ], [ 12.548443206315813, 0.5408091878566331, 27.578914679575742 ], [ 15.271768328759514, 3.406445144274784, 27.776875319644848 ], [ 13.318926353867178, 2.4638095610322086, 28.693069018556045 ], [ 12.217496112873098, 4.072476984326903, 4.072447662375328 ], [ 14.902376898807407, 3.894199518751146, 1.3558291218557434 ], [ 13.575004730955163, 5.429936732489677, 2.7150302681426077 ], [ 12.315838680460894, 6.976734837961205, 1.2332356713181456 ], [ 14.932464479117936, 6.787494220491033, 4.072447662375328 ], [ 14.932480769091033, 4.0724932743, 6.787471414528697 ], [ 13.574972151008968, 5.429985602408967, 8.144999580578478 ], [ 12.2174798229, 6.787494220491033, 6.787471414528697 ], [ 15.745725096022548, 7.635257000415515, 16.86285724208502 ], [ 12.2174798229, 4.0724932743, 9.502493537684755 ], [ 14.932480769091033, 6.787494220491033, 9.502493537684755 ], [ 11.629542113875859, 4.446625086423393, 15.325460080087886 ], [ 14.932513349037226, 4.0724932743, 12.217515660840814 ], [ 13.565409936800911, 5.401184929973118, 13.803637761368984 ], [ 12.217447242953806, 6.787526800437227, 12.217551498781628 ], [ 15.49363776234338, 6.23283692650447, 14.991598710458081 ], [ 13.364750048189602, 5.788560490224534, 22.903803172496403 ], [ 13.05100516633753, 7.573485422430934, 24.459772532821656 ], [ 14.867288296756039, 6.406667229424691, 21.19390985637571 ], [ 14.764237926943151, 4.358186822478694, 19.987202406246354 ], [ 15.21589372103612, 4.668429360114867, 25.806585154568097 ], [ 15.228795379729101, 4.083212076597958, 31.31188581859466 ], [ 11.979890565277339, 5.149977254841197, 32.75583554991971 ], [ 14.40348018273256, 5.579283205844806, 32.83643182081541 ], [ 15.34289035130189, 5.198667984428728, 29.262481770174052 ], [ 14.508273579666849, 6.972743794552391, 26.33647517345768 ], [ 13.878649829486971, 6.924883853592817, 28.728871121429073 ], [ 13.635847780473204, 8.545638436925636, 34.071773785655026 ], [ 12.217463532926903, 9.502446296762775, 4.072447662375328 ], [ 15.035107599603393, 9.657298781024757, 1.224901721081618 ], [ 13.574972151008968, 10.859971204817935, 2.7149129803363077 ], [ 13.574972151008968, 8.145002838573099, 5.429975828425109 ], [ 14.932480769091033, 9.502478876708969, 6.787471414528697 ], [ 13.574972151008968, 10.859987494791033, 8.144999580578478 ], [ 14.044204826073814, 11.029061125566873, 16.9782912494464 ], [ 12.2174798229, 9.502495166682065, 9.502493537684755 ], [ 13.574972151008968, 8.1449865486, 10.85995328584753 ], [ 11.969953681688047, 9.302340267236769, 15.119162231787636 ], [ 14.932464479117936, 9.502478876708969, 12.217551498781628 ], [ 13.51958624247849, 10.772021640066153, 13.674455016713567 ], [ 15.067638675878502, 11.038525599936344, 23.866825657070123 ], [ 13.007673837898977, 9.896288976333778, 23.704978258360207 ], [ 12.268060189366807, 9.798809777320132, 21.41871148511707 ], [ 14.223720329604959, 8.62060489311895, 20.466647265445832 ], [ 12.749722113904815, 11.748947616678334, 20.140608340897305 ], [ 14.913258600836338, 11.586406265114473, 19.10901484356823 ], [ 13.54237591484147, 8.677326579443399, 16.88776949794257 ], [ 15.695503108963882, 10.79595161054594, 26.130384207815762 ], [ 14.823435689178377, 8.824881155757836, 30.035160806098922 ], [ 15.048905206816722, 7.724802982530824, 32.178702980050936 ], [ 11.689766144416208, 9.869573420454369, 32.978879490563884 ], [ 13.168162652852592, 10.297511013717815, 29.274818166800564 ], [ 12.521890550167377, 9.187870626282743, 27.3173123726105 ], [ 14.353307065593185, 11.838966008013461, 27.97417947379813 ], [ 14.157957708211562, 13.090475771152047, 34.366972533135936 ], [ 12.402468757391805, 12.257911536127251, 1.3559236036997073 ], [ 12.2174798229, 14.932480769091033, 4.072481871318832 ], [ 14.932464479117936, 12.217512402846195, 4.072517709259646 ], [ 15.018915366344777, 14.920181839402646, 1.2171900478174036 ], [ 13.574972151008968, 13.574972151008968, 5.429975828425109 ], [ 12.2174798229, 12.2174798229, 6.787471414528697 ], [ 14.932480769091033, 14.932480769091033, 6.7875056234722 ], [ 12.2174798229, 14.932480769091033, 9.502493537684755 ], [ 14.932480769091033, 12.2174798229, 9.502527746628258 ], [ 13.575004730955163, 13.574955861035871, 10.859987494791033 ], [ 12.217463532926903, 12.217414663007611, 12.217551498781628 ], [ 12.089538374194591, 14.935624733898793, 14.828029461591788 ], [ 15.512599291028518, 11.658407946204097, 15.0248856414849 ], [ 14.932480769091033, 14.932480769091033, 12.21748145189731 ], [ 11.994567831037916, 14.670440261849473, 17.20285178658592 ], [ 14.360425783836659, 14.723219774684402, 21.792129796418806 ], [ 14.838471334347092, 13.406322059533657, 23.743054441477597 ], [ 12.270682875035456, 13.746945396996109, 21.36861004385932 ], [ 16.095617428177306, 15.016374130541614, 20.169138599779743 ], [ 14.860609407786187, 13.944265841122492, 18.549594361448044 ], [ 13.108215551854896, 14.140462277105168, 25.168394507536405 ], [ 14.591596792059025, 14.397794982121637, 30.964586850156977 ], [ 12.822473133756912, 13.16980794013541, 32.28180059078581 ], [ 15.880736393052143, 13.059345632563296, 29.351141577752873 ], [ 14.356027491100416, 15.747337803359171, 26.46441662216309 ], [ 12.380819383145624, 12.7131674142747, 26.870292704860994 ], [ 16.205362976933145, 14.766990932396578, 27.764677387789664 ], [ 11.004199368625924, 16.128655122615736, 14.836387846787959 ], [ 4.044580405397948, 2.0713270942148205, 32.69074407541792 ], [ 11.241899398065648, 3.582440384619623, 16.435729260484507 ], [ 2.6013783838380626, 2.864353935535401, 14.929905324344364 ], [ 16.331132972224697, 8.712418439489388, 16.0766282065379 ], [ 3.189728229181564, 8.95104862639296, 16.744165240104202 ], [ 2.8646829929919644, 2.796476875633988, -1.317806695649569 ], [ 3.3173813453631524, 7.989335855656255, 17.962534681973846 ], [ 12.01177167162587, 4.035941832664503, 16.80007894376303 ], [ 6.649553986298562, 3.801649665596714, 16.389617233638266 ], [ 3.186581006379185, 14.072870291732958, 0.5092229300211623 ], [ 13.760299916941193, 8.487400154105835, 26.771793753531465 ], [ 13.733959030443021, 2.1599347738797303, 16.72044703927468 ], [ 10.382557705263675, 2.7820602494429663, 34.11621771925612 ], [ 4.095116788937392, 12.891198901256688, 34.11096257393496 ], [ 3.2167418915686508, 7.586921392241503, 16.053305852054642 ], [ 6.208815732175339, 14.933410926554885, 32.64052697535118 ], [ 1.8549001406427308, 5.438083348035586, 18.1739117438858 ], [ 0.627326863973172, 14.365742831055586, 16.071044003760182 ], [ 1.2974165363238037, 4.804779692933051, 19.00951894588515 ], [ 13.936990739137283, 7.965705620681456, 18.373770165820726 ], [ 11.371075626731825, 12.225939205929377, 19.296325099226383 ], [ 12.18647837509872, 14.383546142653516, 31.79089247751783 ], [ 8.003309394579032, 12.679795775387776, 33.093660270004065 ], [ 10.75522993579756, 9.507404964573562, 15.96574561765988 ], [ 11.505508629716468, 13.297267205637143, 33.169213165228875 ], [ 14.304297052532949, 13.120206601051745, 31.80672144437638 ], [ 12.43379437565772, 7.829876567002382, 15.880156470009881 ], [ 14.808320223141486, 15.440480322132595, 18.902915732939768 ], [ 14.920620039678962, 4.276898227726356, 18.3229519657467 ], [ -0.38107134066279963, 11.265462844150747, 21.088823239925674 ], [ 0.23222496948175406, 1.593723001975323, 18.503413916714795 ], [ 3.9610389073662673, 0.2323504022746025, 33.01095444759227 ], [ 14.243258523337738, 12.952594180862725, 19.679145982999824 ], [ 2.4842339293014777, 14.18943971021921, 17.923376844642792 ], [ 14.53130760162629, 12.799202907187562, 15.147443254081685 ], [ 13.8090199684803, 15.659393125599319, 30.495645765610572 ], [ 9.574166161317816, 9.978214509034217, 32.205328941078314 ], [ 13.345505073972571, 16.246596156836777, 29.86365019534774 ], [ 10.709507239308339, 8.709181621834974, 18.99667918908994 ], [ 17.647476828290138, 6.787494220491033, 9.502493537684755 ] ]
[ true, true, true ]
H41Si432
H41Si432
A432B41
[ "H", "Si" ]
[ 0.08668076109936575, 0.9133192389006343 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
473
2
3
[ 1, 1, 1 ]
[ "training_structures_interface_290" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/8439/MD_1018500113662235199228439.json
null
{"energy-sigma": 1.419, "force-atom-sigma": [0.1, 0.1, 0.1, 0.142, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.118, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.172, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.165, 0.1, 0.1, 0.1, 0.1, 0.1, 0.147, 0.152, 0.1, 0.1, 0.1, 0.1, 0.163, 0.1, 0.1, 0.1, 0.1, 0.161, 0.1, 0.1, 0.194, 0.1, 0.1, 0.1, 0.2, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.111, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.104, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.256, 0.1, 0.1, 0.1, 0.128, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.174, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.143, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.165, 0.1, 0.178, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.15, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.115, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.114, 0.1, 0.1, 0.291, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.168, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.108, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.122, 0.1, 0.131, 0.211, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.242, 0.1, 0.1, 0.1, 0.1, 0.1, 0.218, 0.1, 0.152, 0.1, 0.1, 0.1, 0.1, 0.104, 0.1, 0.169, 0.111, 0.176, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.134, 0.1, 0.1, 0.1, 0.1, 0.112, 0.147, 0.1, 0.1, 0.1], "virial-sigma-alternate": 11.825000000000001, "virial-sigma-paper": 11.825000000000001, "hash": "10185001136622351992284398017860540023545744975803433740641501064614564157109208605716897305023640185834438640845945301965847583375212311839879489910879402", "id": "MD_1018500113662235199228439"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_1007331859202639866564202
10073318592026398665642025566012090036442953856193185657084356983288277500682497364412160048117028101540284382081393438382996182391515953081596748555209563
2025-04-16T18:55:55
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-6,930.227581
[ [ -0.13203448572662832, -0.7277781003632433, 0.2169663219881439 ], [ 0.012991538072176229, -0.47161399221678196, 0.17483593310166543 ], [ 0.0976585504857165, 0.9700849792762348, 2.498601692783095 ], [ 0.2752627926855854, -0.3674613439134354, 1.6456447019188662 ], [ 1.5546679399391508, -0.023491417978596954, 0.83860225275131 ], [ 0.18125418331235107, 0.01564671853629315, -0.0834521651497703 ], [ 0.07144998840478706, -0.14167124557707533, 0.07889051009076357 ], [ 0.5306745954153713, -0.809759079048825, -0.7025653273728072 ], [ 0.8810501731448267, -1.0507570082433288, -0.5902319361618135 ], [ -1.018881730036793, -0.8652245056782513, 2.6342372686211233 ], [ -0.35166730104229776, -0.007343591015406943, 0.08944464031943943 ], [ 0.6064615242741843, -0.05426240645012917, 0.49843781980082286 ], [ -0.7761161659346872, -1.5223059514955108, 0.9329391922739273 ], [ -0.8225953223596643, -0.8056797633478778, -1.341953711929468 ], [ 0.32312083289375765, -0.11214595763315488, -0.2718393659518082 ], [ 0.08895407342435518, 1.1531078259383156, 0.5305516965810684 ], [ -0.03029713376102892, 0.11143016191202564, -0.5061272244817896 ], [ -0.2622458006707397, 0.33473991494603883, -0.12132171829969936 ], [ 0.5755720078473933, -0.22811437754577393, 0.10353044081587069 ], [ -0.031766006230429515, 0.5214386708843355, 0.2619627219749913 ], [ -0.14486455838469928, -0.5294078118241344, -1.6978854482557633 ], [ -0.08862394350124816, 0.24481473504226378, -0.21958756386203485 ], [ -0.7320916437588557, 0.5442847414275753, -0.41338925535777254 ], [ 0.4020324260481465, 0.04168044545545252, 0.3707842404291948 ], [ -0.16142427642017698, 0.8575870373247513, 0.30623946958272946 ], [ -0.11308518240660498, 0.17994394804120362, -0.04684245360671382 ], [ 1.1123750899038696, -0.596248836832024, -1.5140380481175106 ], [ -0.31380109032928494, 0.5921219556826544, -0.14415776153219056 ], [ -0.1856682569259813, 0.6261366506260854, -0.5479711922356036 ], [ 0.3752435654964596, -0.1838972795814633, -0.6470459075316577 ], [ 0.979553845949276, 1.0002730981716892, -0.9305033270936189 ], [ -0.7788003998889219, -0.9599118868560048, 0.8877892972994669 ], [ -1.3871642849894836, -0.0008836888985348948, -0.5515812812156236 ], [ 0.8070262512040395, 0.30159373937975387, -0.4784796147531733 ], [ 0.6365560549359854, 1.1975794633293209, -1.5841963132094554 ], [ -0.8259830107294912, -0.9257524386830494, 1.6731748121343522 ], [ -1.1671015808642855, 0.09030030416998472, 0.3585843456850921 ], [ 0.07232262155044532, -0.1143599364243344, 0.3792557753485507 ], [ -1.1516165848526296, -0.18371293133000868, -0.27420863950432467 ], [ -0.6210882853299746, 1.3398142951925727, -1.7107646290254492 ], [ 0.4233528026944104, -0.07738872747326508, 0.19177103251388478 ], [ 0.7854122543302147, -0.5389406990196475, -0.39294382585195503 ], [ 1.083494635174242, 0.4410836592032155, -2.260808389259624 ], [ -0.4102342520194188, -1.3230656009160642, -0.3029104024142017 ], [ 0.19737372811701948, -0.29463144328332486, 0.1823402181995816 ], [ -0.7724520837429443, 0.44467343645120627, 0.5718850428183008 ], [ -0.04775828132175057, 0.3599467743942386, 0.09586777563023335 ], [ -0.2521668107052272, -0.007969398050330985, 0.6609463313345062 ], [ -0.5280584957521207, 0.23612491328122728, -0.1453898352016055 ], [ -1.0738090243227123, 0.20230845055797966, -0.24390482086946338 ], [ 1.2849335379129478, 0.10132494667224766, -0.4146861208812552 ], [ -0.6360017246289615, 0.12664082098602167, 0.012918775791616039 ], [ 1.4034586649559222, -0.8884459575982326, 1.0719205474650637 ], [ -1.3398430915721584, -0.2216483047761335, 0.2987205291844883 ], [ -0.1575853590666639, 0.8290598524661125, 0.43555064055425696 ], [ 0.08909574132749534, 0.377629551233557, 0.413657678753196 ], [ 0.2914409586915531, -0.14491495204897417, -0.024058860922753635 ], [ 0.5399956235325042, -0.9707089865374348, -0.23723434522687115 ], [ -0.48711724307621074, -0.3729015456603367, 0.580949731735015 ], [ -0.010501936790676843, 0.16789497717939367, -0.10252051064611652 ], [ 0.33616790684084913, -0.22682522533825164, -0.8959031914687902 ], [ 0.9166576678340896, 1.2842794487195022, 0.8124836793565858 ], [ 0.38972711598591775, 0.06763935320979558, 0.08009892959123317 ], [ -0.09181957030366021, -0.7425701834911191, 0.30336188850841966 ], [ -0.24746991550638064, -0.7579528495110331, -0.7022881622192952 ], [ -0.9275262442434196, 1.076074168109763, -0.82179339461031 ], [ -0.2701637766146677, -0.08477602727911455, -0.263953014603318 ], [ -0.4743349929770946, 0.22214607076611415, -0.35589702640447335 ], [ 0.6445575918028184, 0.6176162647056467, 0.7476427171772394 ], [ -0.2844948605586411, 0.3298373313215805, 0.04599450307212899 ], [ 0.9096244092308243, -0.25881671750525814, 1.1043637828368202 ], [ 0.22873401392792958, 0.5864817219418456, -0.5485116385738987 ] ]
[ [ -47.959262541057754, 8.078660340194197, -2.461487522479636 ], [ 8.078660340194197, -46.047569056161024, -8.921236262851382 ], [ -2.4614875224796355, -8.921236262851382, -41.77772283175205 ] ]
true
null
null
null
null
null
2.95397
1.068444
null
CO_5868679870752639667799543
5868679870752639667799543284937263703464350147432191501662769567258448202937196824898699601605310075038621914580899199187145165827780723726138116420385543
3889080289234057335164993810054071910208956554073036257084791270352026261426917187498324387302492038166643311979941572663876569979409226288283053718760475
[ [ 11.2999927403, 0, 0 ], [ 0, 11.2999927403, 0 ], [ 0, 0, 11.2999927403 ] ]
[ [ 9.39181946620924, 1.8964325816335879, 3.817487847448289 ], [ 5.524702050645554, 5.009806581441044, 3.580798199509965 ], [ 4.081207078021411, 7.90731681993055, 2.0350269925933673 ], [ 0.6082989491972816, 7.497002783537517, 7.495601584437719 ], [ 1.5546417012177338, 9.89988973979861, 5.426403413797684 ], [ 3.9532007602592927, 1.0193825150959293, 0.8820898632998323 ], [ 6.930884447241227, 0.4005045126951789, 8.23724270796909 ], [ 2.816218090715787, 10.238268022406894, 8.135621873255571 ], [ 10.315932872510976, 9.436228437678619, 6.262342976746857 ], [ 8.255232296411645, 7.576554732429227, 11.273901057062648 ], [ 5.329370376136728, 3.2175486328802823, 5.923783894254728 ], [ 8.19061893792261, 7.156601802228718, 4.421020459707712 ], [ 10.122363996869636, 3.5313494312784126, 7.979907973294236 ], [ 2.642469402340934, 7.307411505340762, 0.431698142654777 ], [ 7.527761363776613, 1.9460960497272066, 0.21781188006637864 ], [ 0.04864081875062135, 7.967715281127452, 2.3183969105418702 ], [ 0.8290895073500033, 1.4492353689362154, 7.553254147398729 ], [ 9.634916210031314, 3.873456711490995, 5.083053134383668 ], [ 5.7803869863803214, 5.2033528570969025, 1.0314000573752384 ], [ 5.123744408241489, 4.1428259384342665, 8.361712128003493 ], [ 0.2644989300722021, 6.905493363553773, 10.229465328062199 ], [ 0.08176900746735886, 0.5384164040934443, 10.761796686064992 ], [ 9.40043006067735, 10.592997394510391, 4.360181298793937 ], [ 8.883398892844923, 10.888786004480483, 9.439799235384555 ], [ 5.57843351612568, 1.3217036508691895, 10.118996599033027 ], [ 0.18284744252934237, 10.847665330898533, 1.730706888104348 ], [ 5.662923561844904, 7.668005573676476, 0.3564921709709844 ], [ 9.87281495719285, 2.418605246162851, 10.651045457217313 ], [ 7.417111834863595, 10.639474264651245, 0.5912822901296638 ], [ 1.9441863509540958, 9.89991233978409, 3.0930453128676563 ], [ 0.5160017384937852, 8.689502317414115, 0.2961095297639173 ], [ 4.4032342711344805, 6.407954683198363, 9.786110112896528 ], [ 9.966130297242248, 5.983052356177603, 1.3203815517185744 ], [ 11.145759139387646, 1.8856071885883803, 2.297853523740005 ], [ 0.01874216795906158, 4.975624103401636, 6.784978940978473 ], [ 10.74056399970597, 6.254489481792349, 3.57493350327775 ], [ 3.4358531926301374, 4.93054843236058, 1.0591957795178284 ], [ 3.3730591329722905, 1.230230209636461, 6.653424425495899 ], [ 10.960088958671777, 4.706932876022783, 10.834557339319783 ], [ 5.250665926700538, 7.884298734718557, 8.269628487162787 ], [ 3.085745517557423, 4.288821844638942, 5.449794398770106 ], [ 1.9369769555857843, 2.102962548948051, 11.264974062797812 ], [ 9.234116767525613, 8.49795614047329, 9.58013384522634 ], [ 4.968448608011546, 10.370048537744271, 9.94395971148578 ], [ 1.57333188921019, 1.9733403322240697, 4.810666809378738 ], [ 3.5431692236847665, 0.39479688636205335, 4.0091018243455565 ], [ 2.0450161861757925, 5.758397200507698, 8.582920785887605 ], [ 6.98034451546552, 9.62348061737813, 4.305059934206754 ], [ 4.986856296185495, 5.754600402946957, 6.509451217991737 ], [ 7.60603641348867, 1.1958443317277283, 2.470822512615777 ], [ 8.367249124446241, 9.26827664557954, 2.2879208301212817 ], [ 0.9108596448166362, 4.349412405712432, 4.438671048368061 ], [ 0.9779872516903884, 3.97268194774357, 1.1978896304137225 ], [ 8.405070200148025, 8.322851452969601, 6.852349497696141 ], [ 9.819094791705465, 0.1572766889573175, 7.187269982525893 ], [ 7.989964966833103, 4.360226498764899, 2.72780694751568 ], [ 3.3124120719351002, 6.291406558074908, 3.997270731946463 ], [ 6.095611583863731, 9.883188350528446, 6.987689510746715 ], [ 6.69333599985464, 7.634320295317641, 2.6028855277716634 ], [ 4.678852394063138, 10.369054138383126, 2.361009183165542 ], [ 0.7293467314299232, 7.642399790126956, 5.2516942260399055 ], [ 7.416388635328215, 0.699961100308773, 5.731254617945497 ], [ 5.014247478587982, 2.947331906481488, 1.9369543556003037 ], [ 3.4264741986556886, 2.630977309724049, 8.958871544357386 ], [ 7.935103502078947, 2.3336971007122367, 6.333544231003487 ], [ 0.23811570702214965, 10.16053537234637, 4.800700215781792 ], [ 10.002990873561107, 1.9912847206956659, 7.449260314209749 ], [ 1.9685265353167019, 3.0524783389299794, 8.648483343766825 ], [ 3.525529935017158, 8.56730419592051, 7.402907743989037 ], [ 1.6944113114225043, 8.866629703618317, 8.191635937269238 ], [ 0.4365786095193126, 4.890444758125255, 8.312014759931653 ], [ 4.804632613255417, 9.126868536427427, 0.06186294025604638 ] ]
[ true, true, true ]
H8Si64
HSi8
A8B
[ "H", "Si" ]
[ 0.1111111111111111, 0.8888888888888888 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1 ]
72
2
3
[ 1, 1, 1 ]
[ "training_structures_liquid_203" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/5496/MD_3660267252692185023385496.json
null
{"energy-sigma": 0.216, "force-atom-sigma": [0.1, 0.1, 0.134, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.148, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.104, 0.104, 0.1, 0.1, 0.1, 0.113, 0.1, 0.1, 0.127, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1], "virial-sigma-alternate": 4.795926254105775, "virial-sigma-paper": 4.795926254105775, "hash": "3660267252692185023385496716718222525843251605006962997359657674696655869831570033261404815442937463702613447246308389713141972140016118672202089534834774", "id": "MD_3660267252692185023385496"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_1011482666302299867951560
10114826663022998679515607176793475151237108258588366233811767946700932430549034131235441881927924335708711118883006126208695584885239132309233378350382038
2025-04-17T18:37:27
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-6,970.076735
[ [ 0.5747921916037922, -0.2977681917739055, 0.2543591922117175 ], [ -0.12614305499604103, 0.6246112138396416, -0.30756307460154164 ], [ -0.41529572995266234, -0.2207764429620713, -1.0942410840808654 ], [ 0.17637371119364598, -0.653041725138243, -0.8453138660790247 ], [ -0.022958170735198243, -0.2492138962450371, 0.09162442340986097 ], [ -0.16553341694283766, -0.2921449273282097, -0.06541071911829123 ], [ -1.090574430783802, -0.45646246856514927, -0.4762558657617773 ], [ 0.05225643007934963, 1.0177445301536916, -0.505229137393462 ], [ 0.1965098367294497, 0.8432407838593892, 0.7302872420451758 ], [ -0.19558398170366437, -0.7387983719864619, 0.7429939016478797 ], [ -0.5475037652884006, 0.3900906702781867, 0.8189932038061367 ], [ 0.1776255823740261, 0.6695232815719883, -0.2626142400631169 ], [ -0.5933563433468575, -0.07212258955653779, -0.30860642914045777 ], [ 0.14677437541650526, 0.4006154899062128, -0.6018623310775034 ], [ 0.44700311498179246, -0.45906699825445924, -0.973095743606128 ], [ 0.134962717575745, 0.04671389834070642, 0.27880011938504506 ], [ 0.5877284509115854, 0.06708887956075188, -0.16260749908850913 ], [ -0.31015731986957107, -0.07730079567131602, 0.5187210125609389 ], [ 0.7414108721022644, 0.08051699131628925, -0.7072179995601472 ], [ -0.2966219930221835, 0.10309412424304154, -0.9026579993658832 ], [ -1.4454620412395853, -0.2569302975318655, 0.18849724410974023 ], [ 0.27673012249179385, 0.6971603497687919, -0.5497262287271366 ], [ -0.15546651117232987, -0.28658336941019735, 0.06574239170459034 ], [ -0.09214712912144707, -0.5081378288421454, 1.1573444932848556 ], [ -0.211794286526134, -0.654849726399371, -0.5037157848020227 ], [ 0.004367536607335542, -0.6086891299235605, 0.17676323364964844 ], [ 0.13943721216439867, -0.9474749362013843, -0.12270060208289477 ], [ 0.10423440945252722, 0.6176265491269273, -0.5415128327819236 ], [ -0.9487319495924047, 0.27332880726376996, -1.4016367797260652 ], [ -0.017642410485792088, 0.32340931091067826, 0.38024899333372386 ], [ 0.16198529160103328, 0.39173000703031313, 0.679226890160759 ], [ 0.15256450459747872, 0.7834553860710499, -1.01997496401892 ], [ 0.09529827580182057, 0.17752916592452053, 0.21332537974428217 ], [ 0.12217403971332845, -0.20441727114156513, -0.06432776955744487 ], [ -0.19748222876152968, 0.4779630796943555, 0.5016625000933526 ], [ -0.18201214516073072, 0.47575038645583606, -0.11114451211095719 ], [ -0.5125812130564253, -0.08430860033191163, 0.352522450671779 ], [ -0.35395764166148563, 0.34005258986906084, 0.5461534207742589 ], [ 0.013128320875208106, 0.5508588006206618, 0.08141070752557274 ], [ -0.6528036407855972, 1.029366697532357, 1.394478308293709 ], [ -0.14738424159844438, 0.6491657838681197, 0.3572345153920144 ], [ 0.2743785895659864, -0.24557655354862362, -0.030086817345840806 ], [ 0.6291744115618404, -0.16393676053902567, 0.13584717780587593 ], [ 0.8648673791492828, -0.5057500433313238, -0.001428249005342258 ], [ 0.22153569036311102, 0.43051924455325913, 1.0075338995957874 ], [ 0.019713950042235397, -0.2691394482551207, 0.7106375696359442 ], [ 1.4174220808391143, 0.44979199292255706, -0.2637812647679321 ], [ 0.3471586107528861, -0.43248922544955654, 0.5361430793207944 ], [ -0.24583880629127872, 0.7710019803423807, -0.6712608345473442 ], [ -0.36874226858393316, -0.5282189327240979, 0.11001682531754026 ], [ 1.0284850655180782, 0.3176790884836643, 0.34529970160641904 ], [ -0.06453962863582506, -0.22595799151376572, -0.06175640712676477 ], [ 0.16470269281389782, -0.323838685499143, -0.5955099011630135 ], [ 1.7693014980703243, 0.6524436860407765, -0.53162384749957 ], [ -0.12444843947953142, -0.1398994969009613, -0.48711287219716654 ], [ -0.2794637216681753, 1.1757111841393335, 0.17208999261974725 ], [ 0.038556295380940596, 0.09388853875478337, -0.16182639729224815 ], [ 0.31293797027331116, -0.8593202194210633, 0.6571040715440769 ], [ -1.2311696687843954, 0.2880758960485433, -0.45822341859891874 ], [ 0.0902619947007145, -0.6507233594710654, -0.2806194335095819 ], [ -0.5295803329911163, -0.22621227382992837, 0.5699975944027802 ], [ 0.08231419393507276, -0.6982085894078164, 0.7912774597865365 ], [ -0.49997739766652743, -0.045664373149021976, -0.20015566407341964 ], [ 0.9565203418281973, -1.041870239814769, 1.3863795836457744 ], [ -0.2119071580496885, -0.045739963645434326, -0.842924795015543 ], [ 0.08170844152164589, -1.1164006695036255, -0.4752302518495702 ], [ 0.4676200372124639, -0.8988082833700255, 0.11501839649682431 ], [ -0.20681791217898735, 0.016438104753834726, 0.9214458372718012 ], [ -0.002125275657634402, 0.22664987595541755, -0.3337824353248157 ], [ -0.7606975044402913, 0.3742729732381037, 0.008068899826220718 ], [ 0.2513527987608683, -0.1429136036677709, 0.05230039598032417 ], [ -0.11686727833254279, -0.19835357635452788, -0.12681154237927952 ] ]
[ [ 3.5996448393390694, -2.5016399669620575, -2.573331006739251 ], [ -2.5016399669620575, 7.696096006958687, -1.0414066830792275 ], [ -2.5733310067392505, -1.0414066830792275, 4.834743103570713 ] ]
true
null
null
null
null
null
1.980523
0.861082
null
CO_8420663968375219258420840
8420663968375219258420840964900880686878838999883903279187878300010883137283382855332785659804860601906200636051156027587168950652260765141440354251664591
9996850369066417536072334254774454759985306453255527139205768499698290059139255596661168438778706045216919747903330951151040232595517577723707271880347078
[ [ 11.105996452100001, 0, 0 ], [ 0, 11.105996452100001, 0 ], [ 0, 0, 11.105996452100001 ] ]
[ [ 10.702848780888772, 8.027669673496279, 6.440245176611818 ], [ 10.942282958399595, 4.574437772659017, 1.6584473441956409 ], [ 10.168905789461158, 5.953458246119823, 7.4040013367321516 ], [ 4.951008794360372, 4.128743029039792, 0.3777649163199555 ], [ 1.0988084087768055, 2.860938004050317, 0.6366679056113107 ], [ 3.7255842518321103, 7.866621618944377, 0.6150001065332636 ], [ 1.6504843447394852, 0.25890965288922646, 3.2990029281069493 ], [ 4.863804510218483, 2.5654074384599355, 4.701679174010727 ], [ 9.908625656609743, 2.225819384944074, 8.302831841593509 ], [ 2.3708192746226913, 10.631703767616619, 6.882563697309605 ], [ 4.398929710726481, 5.949460087397067, 1.7797470374454774 ], [ 1.9317770228782742, 8.219448020231143, 6.5960178828489715 ], [ 9.60472116969448, 9.75857253854542, 9.992953487670539 ], [ 4.6898957117750495, 10.470911150983115, 6.647893992276731 ], [ 5.575709988794545, 9.31364410868139, 8.464279712017687 ], [ 9.37594874877767, 9.535930627670172, 7.60115498574983 ], [ 0.5741555833813755, 5.571200954234992, 9.130161941296246 ], [ 0.700254177698164, 3.1957171611024187, 9.41333153283544 ], [ 7.54053845711427, 6.0390854787655135, 10.297468804390668 ], [ 9.898919015710609, 0.5073485723234131, 6.713530431308643 ], [ 10.68972149308239, 8.102857269476997, 4.107164077933362 ], [ 10.541256532510717, 4.524805074514583, 5.469247906804714 ], [ 8.558336395970521, 9.049221439153342, 3.567390438368398 ], [ 5.990352366333698, 1.3248676347603654, 6.215693034346808 ], [ 5.534973193808242, 10.761288534219721, 2.941356524359973 ], [ 2.808351110849623, 5.858724096383409, 3.6965531771063205 ], [ 7.352647209137642, 8.421599367652266, 7.234468300890845 ], [ 3.8212290932775956, 1.1901296858034882, 3.110334260378674 ], [ 2.280038859623226, 10.719529987559826, 9.293342347166952 ], [ 7.864122769742655, 6.206852661170936, 7.957146596025445 ], [ 6.901754859178833, 7.989309561750726, 4.838704958236737 ], [ 3.8679298083586757, 4.849844272678193, 7.509697104966787 ], [ 6.235950371875439, 2.832984210980381, 7.9885765659848875 ], [ 7.927215935587035, 2.4511156289713747, 9.56558363819728 ], [ 0.8787708540695742, 0.6893858495701389, 5.476244684569537 ], [ 8.901711594276549, 3.433940784999964, 2.0404380921656204 ], [ 4.151288201837556, 7.79011240938586, 9.438042374941363 ], [ 7.948672720732492, 7.5182820402242605, 1.9477918697622025 ], [ 1.3920367013026664, 8.176578873926035, 0.847318672117227 ], [ 3.380387670107938, 2.737916881350405, 1.3794425013259848 ], [ 4.98828051845362, 9.238478724693577, 4.640540663541917 ], [ 8.976188406484331, 1.1775354858268068, 1.5304174170958322 ], [ 8.123736542806945, 1.29628079989266, 5.256734664693782 ], [ 6.246634340462358, 6.294245747252511, 3.2607094523401083 ], [ 5.325991658569077, 9.44971477721252, 0.9877784304462263 ], [ 1.1799343810604606, 3.0234409441374437, 5.810457435802583 ], [ 1.3161050035596584, 9.03747129490702, 3.0726405084202466 ], [ 11.021513137088876, 6.437713009420738, 0.09978515692282808 ], [ 3.225881047466323, 4.023269380734199, 5.41543935399429 ], [ 2.983037329044704, 8.09187343898587, 4.454093195104062 ], [ 0.17714397520993067, 0.7747365429041727, 1.361373045098418 ], [ 8.708767117914215, 3.4597511207546443, 4.4339247055470485 ], [ 8.024004694667086, 0.3932411223759569, 10.661956501952139 ], [ 3.848527632556857, 1.0589700889034777, 9.956225957403444 ], [ 9.07333255745085, 7.6541083768334435, 11.067180994499912 ], [ 5.863999444698157, 10.67164093085837, 10.259241964602541 ], [ 7.361498688309965, 3.9457051015127322, 0.28294969280944215 ], [ 0.31419641382742547, 5.867286819647978, 3.5878476838331657 ], [ 6.624238219833758, 4.3569046201517345, 4.6721927534304015 ], [ 6.198689753778643, 4.97765207984896, 6.939159855229506 ], [ 0.6616219690395342, 10.19831446806632, 10.834332672885184 ], [ 7.8261180498835685, 0.17574128785803042, 3.213009197578339 ], [ 2.5803227916951057, 6.635244262317789, 8.233608165707569 ], [ 4.25486272474984, 3.348080326428779, 9.16175850120247 ], [ 1.3072091004015265, 3.084646090584967, 7.362520439983558 ], [ 3.0323701652849318, 4.033842289356598, 2.484711268238977 ], [ 3.09920605193367, 9.454679157626607, 9.432489376715314 ], [ 3.6088158051347303, 1.1865091309601037, 0.30137898332205687 ], [ 9.6878606591349, 3.404276668476405, 7.407799587518769 ], [ 6.225977187061452, 6.682711291154065, 10.524342099914168 ], [ 1.986929401259403, 2.646281304624128, 8.897546845607012 ], [ 6.696560468729833, 8.591865399259412, 1.282498258295604 ] ]
[ true, true, true ]
H8Si64
HSi8
A8B
[ "H", "Si" ]
[ 0.1111111111111111, 0.8888888888888888 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1 ]
72
2
3
[ 1, 1, 1 ]
[ "training_structures_amorph_180" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/3032/MD_7437601252283420792583032.json
null
{"energy-sigma": 0.108, "force-atom-sigma": [0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1], "virial-sigma-alternate": 3.6, "virial-sigma-paper": 1.8, "hash": "7437601252283420792583032536841247680727192260998411611718671459637264176605532834896249122585767659962561949078227790836998001449632680599596060583127913", "id": "MD_7437601252283420792583032"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_4485426098283503947384409
4485426098283503947384409924827815074044706072426382197659357714757175172982242966577121868088681715434164318135098103079956777468613890391534036551984865
2025-04-16T18:26:36
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-6,962.964383
[ [ 1.0428027797143866, 0.6119459490325921, -1.1910964212645674 ], [ -1.1193728672537167, -0.5919638327054653, 1.1000435545673755 ], [ 0.12096921976030704, -1.0792985912917605, -1.2266882322113775 ], [ 1.3222590451771334, 1.4648319773899847, 0.2727356532664118 ], [ 0.14715284211963106, -0.307152211971382, 1.8777684611008791 ], [ 0.1643797619856872, -0.8222999023583791, 0.2151233536946617 ], [ 0.7944373482249985, -0.01952265980641638, -1.630008524914386 ], [ -2.101452052848442, -0.6107773816645848, -0.43796567978147194 ], [ 0.0916804735058402, -0.9016457552013409, -0.4004154579123053 ], [ -0.9110153772090246, -0.8679491059860123, -2.158780502392848 ], [ 0.5819030975877258, 2.0836692600121696, 0.9299222572912655 ], [ -1.1534706088989886, 0.9371231519614044, 0.2668863886630749 ], [ 1.3277918067155603, -0.5443973558405978, -0.12588003092178987 ], [ -0.2753754070986078, 1.5649068526555765, -2.316494416725519 ], [ 0.7796401228864822, 0.33949825956203694, 0.7750090479838315 ], [ -0.3242791158404844, 1.2042784782409668, -0.44416795714526525 ], [ -0.8021316380060736, -0.135519361877557, 2.1678001969664593 ], [ -0.078585319889262, 2.235796676705223, 0.12648218378776857 ], [ -1.1332393524663393, -0.753263153407083, 1.2879982954545643 ], [ -1.1872814151905318, -0.7761002250817023, 1.671544474250846 ], [ 1.706266737378382, 0.4689510984367045, 0.9777245045139906 ], [ 0.49430759621453696, 0.8804238518888385, 1.0975470113015116 ], [ 0.40992443382834104, 1.0791458676357437, -0.6251514030674047 ], [ -1.4702199856988871, -1.2496672288996686, 2.7627745368912864 ], [ -0.7317129199451979, 1.0552410159216672, -2.476898478554661 ], [ 0.8814430380377454, 0.41087908523371197, -0.6976028369943894 ], [ -0.3170244850691546, 0.1531386324154678, 0.0029513717969979797 ], [ -0.19906782941246504, -0.5288941049811688, 0.8289837477486363 ], [ -1.2160927071870469, 0.22597213259302654, 1.1856886154447 ], [ 0.15144504534108627, 0.7276624006238366, -0.14066620050742945 ], [ 0.2416905849677518, -1.7996747365488295, 0.4763119158577565 ], [ 0.799847468039654, 0.6974151463060186, -0.5078200402245752 ], [ 0.19193738302809837, -0.23871375922808435, -0.10694306890730322 ], [ -1.4405183199300045, -0.6161219382935766, 0.20731233573205185 ], [ 1.227482960865835, -0.3756294884050138, 1.04869626732923 ], [ -0.25928697266831324, 0.7363833327592468, 0.9379983562123827 ], [ 1.5278855071507642, -0.4709059098116132, 0.8078433484747827 ], [ 0.5646077863201538, -0.836397015718219, -0.659101049046236 ], [ -0.8298736072999393, -0.000435031020169055, -0.679121989063697 ], [ -0.5683027217757386, -1.0064784608618667, -1.6846951637423393 ], [ -2.067539430786221, -0.07735273199878302, 1.2251509683404609 ], [ 0.30154823081558724, -0.07567714266164251, 0.07199866228010665 ], [ 2.760117299542913, 1.0154732157138726, -0.25885476986399636 ], [ -1.346073393983941, -0.14019671667597042, -1.0771200937539993 ], [ 0.33539040459203634, 0.857022679706979, 1.337958214261958 ], [ -1.9302228662898804, -1.049006856851904, 0.41578449707402254 ], [ -0.8934274741560195, 0.059734747013532326, 0.690338178912311 ], [ 0.6098137313905934, 0.016744837618528394, -1.232552923446635 ], [ 1.6108681884690754, -0.2878933475708128, -0.007476774270990614 ], [ 0.9269166351720124, 0.6754458226769493, -0.11120544730704472 ], [ -0.34765431985861067, 0.7810310908646824, -0.5733269186818398 ], [ -1.1884047311049044, -1.5000136970382312, -1.1070107357639127 ], [ 0.9976022339651195, 0.29491966418971344, 0.08655240394480486 ], [ 1.0249667649979872, -0.2874202641919056, 1.241304194624823 ], [ -0.584613556816226, -0.12291066138755087, 0.2842351789213061 ], [ -1.0709239870429743, 0.6144409496352639, -0.40021568302892985 ], [ 1.7836361815617459, -0.2037626677270554, 0.29354386573290225 ], [ -0.16150320935350554, -0.32809155080919994, -1.423790708717121 ], [ 1.1247912146053967, 0.14900146684481752, -0.9096948575165965 ], [ -0.5204449386780983, 0.6412244108657784, 1.1374287114749884 ], [ -1.0343376725583313, 0.14730350889139174, 0.16891236355457626 ], [ -0.6736038828255952, -1.2992615365305369, -0.6545453075294656 ], [ 0.09147247108544021, -1.1102009632451524, -0.5852964423892573 ], [ 0.8813895590470865, -0.9906527933952911, -0.9258462840272348 ], [ 1.2848222090525854, -0.24388990845860653, -1.3567943889478946 ], [ 0.3152583928247448, 0.2968407940849281, 0.07851692848774607 ], [ 0.17218666617978484, 0.027220292024407716, 0.09329589897848924 ], [ -0.889719683173834, -0.2975077388049745, -0.9584018767014818 ], [ 0.3898574710256492, -0.03430985783418403, 0.43953559668995446 ], [ -0.07776153774468657, -0.17520822915202286, -0.2836582228874649 ], [ 0.6396778910157094, 0.021121887315548486, -0.3863301716369381 ], [ -0.9156366819114587, 0.28137431003157737, 1.171917261128923 ] ]
[ [ 9.926064665291381, -3.043724846680834, 5.298848255812542 ], [ -3.043724846680834, -0.6401884078349358, -1.1747268623140077 ], [ 5.298848255812543, -1.1747268623140077, 3.355643756588622 ] ]
true
null
null
null
null
null
3.369887
1.523077
null
CO_7088206504280424605323490
7088206504280424605323490798980679989544207282328849671471110765247472102358392742496857285644921184782494610901011555152839359513597938243734355962914750
4869083184750667191607516589264279948649025313369575530560773494436950055953849151195935557608339518902857383499027717842775304974245435117575847670646730
[ [ 11.105996452100001, 0, 0 ], [ 0, 11.105996452100001, 0 ], [ 0, 0, 11.105996452100001 ] ]
[ [ 10.661789912005357, 7.91338897000417, 6.500150921474445 ], [ 11.069368875800976, 4.960981979174358, 1.3799422711663294 ], [ 10.132589181062793, 6.01368606487956, 7.659794647016918 ], [ 5.222783633539711, 4.147412209075773, 1.7147103222219797 ], [ 1.1737261290437366, 2.9315388234963162, 0.6610011438378618 ], [ 3.8167089527215907, 7.796742689267765, 0.5718777435090497 ], [ 1.4946450025236182, 0.18939388929659695, 3.578551964802758 ], [ 4.7760338202575365, 2.5503366012744357, 4.255351388593732 ], [ 10.540967776602962, 1.6297605553598666, 8.482893362071406 ], [ 2.4767260567899174, 10.557482393327234, 7.277581779117897 ], [ 3.4714346290222537, 5.6161136038872845, 1.7768150543821228 ], [ 1.9559436711580438, 8.243470290557035, 6.672416032442968 ], [ 9.774865035340651, 10.3129727754378, 9.91120224778663 ], [ 4.7150063697532465, 10.270092523136242, 6.846469208840279 ], [ 5.688091566893345, 9.247152507922667, 8.557136948353694 ], [ 9.701154536888064, 9.71472606455253, 7.601343787689517 ], [ 0.8864850792052029, 5.761402249473657, 8.946924105833048 ], [ 0.24911638521776472, 3.423934282196622, 9.771444388433405 ], [ 6.318134745620978, 6.0614418496235904, 9.579366179794334 ], [ 9.94864056182666, 0.9153118035962737, 6.223733775778127 ], [ 10.328565594456549, 7.836968608417269, 3.992461346576073 ], [ 10.473665438103236, 4.302152057642882, 5.762201881218208 ], [ 8.169948594044133, 8.445821545914296, 3.680393952268515 ], [ 5.447546789737311, 1.4822396044866224, 6.08771863722926 ], [ 5.444548170695244, 10.305476227832633, 3.179013742438461 ], [ 2.2072723708690667, 5.811990063312972, 3.82976960454926 ], [ 7.694800747833938, 8.517888356891973, 7.578443223005286 ], [ 3.773906442395197, 0.9377803450185173, 2.8030424445455195 ], [ 2.488398459061074, 0.5369438316689692, 9.201662346454865 ], [ 8.38655994884589, 6.754433816241727, 8.980342049157416 ], [ 6.917936296009543, 7.81496762944566, 5.466971177532034 ], [ 4.021325831355081, 4.9063071586406695, 6.8453141852092605 ], [ 4.483368601751797, 2.8307519056935084, 7.909512977242388 ], [ 9.007940450340886, 3.003116970630101, 9.860903189855069 ], [ 1.0414725914931942, 0.9069145596788408, 5.660226621795026 ], [ 8.61961928439321, 2.8355941201466246, 2.504624319877592 ], [ 4.336058664811143, 7.544469979858312, 9.411843329310859 ], [ 7.509808164931308, 8.076402785928094, 1.459205767844967 ], [ 1.7512934745351971, 8.660800319237596, 0.9264788830288602 ], [ 3.719453741790551, 2.5177293956910702, 1.0693453107890294 ], [ 5.066166871572197, 8.908919385973961, 4.852176531933134 ], [ 8.967392457294268, 0.7171386241042916, 1.696296580104398 ], [ 7.539683295387458, 0.9110237783661179, 5.611671205306445 ], [ 6.972766600493561, 5.8078031026505315, 0.8681568532603023 ], [ 5.569957082632357, 9.249251541252114, 0.960805296863011 ], [ 1.4714667879280854, 3.150049303691384, 6.154243555977338 ], [ 1.373900609096387, 8.971435040002833, 3.189564439067955 ], [ 0.2255494607464085, 6.954663826276637, 0.2170078388750984 ], [ 3.03542431430926, 4.041827500805657, 4.932417356299557 ], [ 2.85487412998747, 7.856848342066529, 4.613741894103 ], [ 0.34307533640182114, 0.8289127041971617, 1.609236673916386 ], [ 8.739297502161039, 3.1105896982970727, 4.911204903076046 ], [ 8.097059939329, 0.7155604620084484, 10.599585225877146 ], [ 4.389600673706717, 1.5407904177820937, 9.928849676149017 ], [ 9.308313230384384, 8.07474799245673, 10.800581549667251 ], [ 6.041528797984975, 10.78291190931196, 10.339871498844786 ], [ 8.69762780347276, 4.340634335349408, 0.7362464910001297 ], [ 11.008930043108647, 5.623232547613081, 3.8803352063956718 ], [ 6.450284997404516, 3.911631904397689, 3.8077019895989377 ], [ 6.212250175446656, 5.450423242818405, 5.572489249823436 ], [ 1.05020301530419, 10.601151171376891, 10.821605200951076 ], [ 8.564644601955314, 10.90127961949844, 3.836888548275056 ], [ 2.82864176636761, 6.631468223524076, 8.025848290078136 ], [ 1.823693465406437, 2.7016558029342983, 8.410104661324343 ], [ 2.8323178511932547, 4.684542621485137, 10.540034872900986 ], [ 5.82657223665458, 4.652124217841457, 9.14387784691459 ], [ 8.087009012539848, 3.527531017101811, 8.76945028252849 ], [ 2.3583583466034352, 5.038002064569672, 1.0809477452825385 ], [ 10.035445030096273, 11.00725303764438, 4.1503886161249355 ], [ 6.5512273991576535, 0.21518867665624444, 3.468047300104363 ], [ 6.801845315095742, 4.824455964788692, 6.8325422892893455 ], [ 3.359997060621882, 4.528903187205407, 9.907770494882932 ] ]
[ true, true, true ]
H8Si64
HSi8
A8B
[ "H", "Si" ]
[ 0.1111111111111111, 0.8888888888888888 ]
[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 1, 1, 1, 1, 1, 1, 1, 1 ]
72
2
3
[ 1, 1, 1 ]
[ "training_structures_amorph_257" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/6365/MD_2411080854509643997626365.json
null
{"energy-sigma": 0.108, "force-atom-sigma": [0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.112, 0.1, 0.125, 0.118, 0.1, 0.1, 0.14, 0.1, 0.1, 0.116, 0.112, 0.1, 0.11, 0.101, 0.1, 0.1, 0.168, 0.139, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.102, 0.12, 0.1, 0.148, 0.1, 0.1, 0.112, 0.1, 0.1, 0.1, 0.1, 0.1, 0.111, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1], "virial-sigma-alternate": 3.6, "virial-sigma-paper": 1.8, "hash": "2411080854509643997626365427195515475553180545262455515028482266191906797813244092715437780238724646677992484751968591800760122055269625673120660751596622", "id": "MD_2411080854509643997626365"}
{"input": {"encut": {"value": 42, "units": "Ry"}, "kspacing": {"value": 0.2, "units": "Ang^-1"}}, "hash": "3592753035649081965693457215672852401445165267137394292685391428491274929020112919567349937673138123768489898693829296236882327256264852983877693996641003", "id": "MD_3592753035649081965693457"}
PO_1050243927025450182780628
"105024392702545018278062897172889912213219091918248920689090811781872525000901812858836670948365702(...TRUNCATED)
2025-04-16T16:46:17
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-6,956.993907
[[1.4577557813278734,0.09432716932240064,-0.7599243730705227],[0.0692892314937346,-0.156297235301269(...TRUNCATED)
[[-20.098645888413113,-1.8073688449092389,5.9692223646062965],[-1.807368844909239,15.438728302895555(...TRUNCATED)
true
null
null
null
null
null
3.574449
1.39155
null
CO_1459752672848261562576577
"145975267284826156257657745874673225447306896813711753263229779306827854335617819077630917198428841(...TRUNCATED)
"803703725528809906087762949577801439577996537601153829497953725199510367223775790086418084898615358(...TRUNCATED)
[ [ 11.105996452100001, 0, 0 ], [ 0, 11.105996452100001, 0 ], [ 0, 0, 11.105996452100001 ] ]
[[10.743452303917648,8.004047219042663,6.512778439440483],[10.69919490805603,4.827221357905265,1.737(...TRUNCATED)
[ true, true, true ]
H8Si64
HSi8
A8B
[ "H", "Si" ]
[ 0.1111111111111111, 0.8888888888888888 ]
[14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,(...TRUNCATED)
72
2
3
[ 1, 1, 1 ]
[ "training_structures_amorph_214" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/4108/MD_9266966213187473529514108.json
null
"{\"energy-sigma\": 0.108, \"force-atom-sigma\": [0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, (...TRUNCATED)
"{\"input\": {\"encut\": {\"value\": 42, \"units\": \"Ry\"}, \"kspacing\": {\"value\": 0.2, \"units\(...TRUNCATED)
PO_1051970393092161578318111
"105197039309216157831811119524215415475594638330964746052386601422554417747849600736363323524702553(...TRUNCATED)
2025-04-17T17:56:16
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-6,957.422776
[[0.7808377437446072,-0.9148175277564596,-0.2990905112400577],[-0.8027530741619533,-1.26514528292696(...TRUNCATED)
[[-3.166983125596008,-0.6590544709341971,0.12074280383527275],[-0.6590544709341972,-12.7157265289021(...TRUNCATED)
true
null
null
null
null
null
6.436452
1.711835
null
CO_8017203646738729258916289
"801720364673872925891628962392310209249677824636134286186713569678790980069643216012195990459679942(...TRUNCATED)
"962028755427062213792568246129777350160785348623337970524626968076281457024726131523311072818571962(...TRUNCATED)
[ [ 11.105996452100001, 0, 0 ], [ 0, 11.105996452100001, 0 ], [ 0, 0, 11.105996452100001 ] ]
[[10.681769599622687,8.396399861702452,6.572395428395355],[10.514790942965362,5.267607435220387,1.93(...TRUNCATED)
[ true, true, true ]
H8Si64
HSi8
A8B
[ "H", "Si" ]
[ 0.1111111111111111, 0.8888888888888888 ]
[14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,(...TRUNCATED)
72
2
3
[ 1, 1, 1 ]
[ "training_structures_amorph_245" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/3142/MD_6464123147842381366943142.json
null
"{\"energy-sigma\": 0.108, \"force-atom-sigma\": [0.1, 0.1, 0.101, 0.1, 0.1, 0.139, 0.1, 0.1, 0.1, 0(...TRUNCATED)
"{\"input\": {\"encut\": {\"value\": 42, \"units\": \"Ry\"}, \"kspacing\": {\"value\": 0.2, \"units\(...TRUNCATED)
PO_1053280282138495208024110
"105328028213849520802411088051157616828513590052168517687873033403762825446076062850696662240450675(...TRUNCATED)
2025-04-16T21:12:08
DS_8arvjtldu4fw_0
1
Quantum ESPRESSO
DFT-PBE
-13,751.260376
[[-0.16593168115692858,-0.15659162686042666,-0.12264018110787128],[-0.23648486802604804,0.7698151581(...TRUNCATED)
[[-14.084139458945195,1.2329330049748224,-0.88718988717765],[1.2329330049748224,10.020026961065222,-(...TRUNCATED)
true
null
null
null
null
null
2.658383
0.97437
null
CO_9861860629110800630488596
"986186062911080063048859691015859143676062653080723770623624652940105465658473818389638268163972068(...TRUNCATED)
"111328119941670937804591640609791656614976197763921246633734263742659947800363226120282681834795257(...TRUNCATED)
[ [ 11.5187545121, 0, 0 ], [ 0, 19.951070271437317, 0 ], [ 0, 0, 30.916256479194814 ] ]
[[10.125607228879552,15.944713834576596,9.206892102752578],[4.705653112037604,0.25937931410346776,8.(...TRUNCATED)
[ true, true, true ]
H18Si126
HSi7
A7B
[ "H", "Si" ]
[ 0.125, 0.875 ]
[14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,14,(...TRUNCATED)
144
2
3
[ 1, 1, 1 ]
[ "training_structures_diamond111_390" ]
null
data/MD/3457/MD_3592753035649081965693457.json
data/MD/4355/MD_4101584733747289551794355.json
null
"{\"energy-sigma\": 0.07200000000000001, \"force-atom-sigma\": [0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0(...TRUNCATED)
"{\"input\": {\"encut\": {\"value\": 42, \"units\": \"Ry\"}, \"kspacing\": {\"value\": 0.2, \"units\(...TRUNCATED)
End of preview. Expand in Data Studio

Cite this dataset Unruh, D., Meidanshahi, R. V., Goodnick, S. M., Csányi, G., and Zimányi, G. T. Si-H-GAP training. ColabFit, 2023. https://doi.org/10.60732/43a0cef7

This dataset has been curated and formatted for the ColabFit Exchange

This dataset is also available on the ColabFit Exchange:

https://materials.colabfit.org/id/DS_8arvjtldu4fw_0

Visit the ColabFit Exchange to search additional datasets by author, description, element content and more.

https://materials.colabfit.org


Dataset Name

Si-H-GAP training

Description

A set of training configurations of hydrogenated liquid and amorphous silicon from the datasets for Si-H-GAP. Includes virial sigmas used for configurations used in the corresponding publication (virial-sigma-paper) as well as an alternate configuration defined by doubled virial sigma prefactors (from 0.025 to 0.05).

Dataset authors

Davis Unruh, Reza Vatan Meidanshahi, Stephen M. Goodnick, Gábor Csányi, Gergely T. Zimányi

Publication

https://doi.org/10.1103/PhysRevMaterials.6.065603

Original data link

https://github.com/dgunruh/Si-H-GAP

License

CC-BY-4.0

Number of unique molecular configurations

392

Number of atoms

65909

Elements included

H, Si

Properties included

energy, atomic forces, cauchy stress


Usage

  • ds.parquet : Aggregated dataset information.
  • co/ directory: Configuration rows each include a structure, calculated properties, and metadata.
  • cs/ directory : Configuration sets are subsets of configurations grouped by some common characteristic. If cs/ does not exist, no configurations sets have been defined for this dataset.
  • cs_co_map/ directory : The mapping of configurations to configuration sets (if defined).

ColabFit Exchange documentation includes descriptions of content and example code for parsing parquet files:

Downloads last month
18

Collection including colabfit/Si-H-GAP_training