{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" [ 6.02989 5.625866 5.375468 5.19354 5.050567 4.932773 4.832604 4.745466 4.668355 4.599199 4.536511 4.479182 4.426368 4.37741 4.331783 4.289062 4.2489 4.211006 4.175138 4.141091 4.108689 4.077779 4.048231 4.01993 4.000663 3.980385 3.958985 3.93633 3.912265 3.886602 3.859113 3.82952 3.797473 3.762527 3.724106 3.681441 3.633478 3.57871 3.514884 3.438397 3.342952 3.21594 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.02989e-10 5.625866000000001e-10 5.375468e-10 5.19354e-10 5.050567e-10 4.932773e-10 4.832604e-10 4.745466e-10 4.668355e-10 4.5991989999999997e-10 4.536511e-10 4.479182e-10 4.4263680000000005e-10 4.3774100000000004e-10 4.3317829999999997e-10 4.2890620000000005e-10 4.2489e-10 4.2110060000000006e-10 4.1751379999999996e-10 4.1410910000000005e-10 4.108689e-10 4.0777789999999996e-10 4.0482310000000006e-10 4.0199299999999995e-10 4.0006630000000006e-10 3.9803850000000004e-10 3.9589850000000004e-10 3.93633e-10 3.912265e-10 3.886602e-10 3.859113e-10 3.82952e-10 3.797473e-10 3.762527e-10 3.724106e-10 3.681441e-10 3.633478e-10 3.5787100000000004e-10 3.514884e-10 3.4383970000000003e-10 3.342952e-10 3.21594e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 1.11586e-34 6.06566e-07 0.000965002 0.0170185 0.0789631 0.205668 0.395147 0.63311 0.901356 1.18246 1.46174 1.72776 1.97207 2.18886 2.37435 2.52636 2.64392 2.72697 2.77604 2.79213 2.78433 2.75864 2.7111 2.63677 2.52951 2.38155 2.183 1.92108 1.57899 1.13429 0.556281 -0.198088 -1.19118 -2.51712 -4.32537 -6.87045 -10.6343 -16.9236 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 1.787804804085888e-53 9.718258641721728e-26 1.5461036434252415e-22 2.72666428210848e-21 1.2651283272589248e-20 3.295164612466944e-20 6.330952851792577e-20 1.014354040394688e-19 1.444131510217805e-19 1.8945097670311681e-19 2.3419656536881923e-19 2.768176678353408e-19 3.1596044485810563e-19 3.5069403182042883e-19 3.8041280595964805e-19 4.0476749277242883e-19 4.2360268112655363e-19 4.369087579622977e-19 4.447706386405632e-19 4.4734854082343035e-19 4.460988430592065e-19 4.419828513203713e-19 4.343661036650881e-19 4.224571248426816e-19 4.0527217840798087e-19 3.81566373126624e-19 3.4975515632063997e-19 3.077909462686464e-19 2.5298208624769918e-19 1.817332919207232e-19 8.912604127952449e-20 -3.173719624610304e-20 -1.908480747164544e-19 -4.0328708157480957e-19 -6.930006690309697e-19 -1.100767436437536e-18 -1.7038026838573441e-18 -2.7114596259770882e-18 ] } }