{ "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" [ "N" "N" "N" "N" ] } "a" { "source-value" [ 3.13977 2.929394 2.799011 2.704281 2.629835 2.568499 2.516341 2.470968 2.430816 2.394807 2.362165 2.332313 2.304813 2.279321 2.255563 2.233318 2.212405 2.192674 2.173997 2.156269 2.139397 2.123302 2.107917 2.09318 2.083148 2.072589 2.061446 2.049649 2.037118 2.023756 2.009442 1.994033 1.977346 1.959149 1.939143 1.916928 1.891953 1.863436 1.830201 1.790374 1.740676 1.67454 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.13977e-10 2.929394e-10 2.799011e-10 2.704281e-10 2.629835e-10 2.568499e-10 2.516341e-10 2.470968e-10 2.430816e-10 2.394807e-10 2.362165e-10 2.3323130000000003e-10 2.304813e-10 2.279321e-10 2.255563e-10 2.2333180000000002e-10 2.212405e-10 2.1926739999999998e-10 2.173997e-10 2.156269e-10 2.1393970000000002e-10 2.123302e-10 2.107917e-10 2.09318e-10 2.083148e-10 2.0725889999999998e-10 2.0614460000000002e-10 2.0496490000000002e-10 2.0371180000000002e-10 2.0237560000000002e-10 2.009442e-10 1.994033e-10 1.9773460000000002e-10 1.959149e-10 1.939143e-10 1.916928e-10 1.891953e-10 1.863436e-10 1.830201e-10 1.790374e-10 1.7406759999999998e-10 1.67454e-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 0.0610796 0.552392 0.718326 0.783775 0.838801 0.886773 0.929143 0.966931 1.00089 1.03157 1.05944 1.08483 1.10804 1.12929 1.1488 1.16672 1.18321 1.19837 1.21232 1.22516 1.23696 1.2478 1.25551 1.25042 1.23404 1.20472 1.16104 1.10186 1.02658 0.935309 0.829291 0.711379 0.586927 0.46514 0.361029 0.294201 0.228498 0.14073 0.0178858 -0.166113 -1.36676 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 9.786030793406638e-21 8.85029555208528e-20 1.1508851327946839e-19 1.25574599131335e-19 1.343907362775834e-19 1.420766980262082e-19 1.488651204244662e-19 1.549194254890254e-19 1.60360257120426e-19 1.65275735033538e-19 1.6974100131249597e-19 1.7380892778622198e-19 1.7752757975373598e-19 1.8093220510098598e-19 1.8405805171392e-19 1.8692915224204798e-19 1.89571141511514e-19 1.9200004128865797e-19 1.94235077693088e-19 1.9629227249114398e-19 1.98182840919264e-19 1.9991960039051998e-19 2.0115487857533397e-19 2.00339370668628e-19 1.97715005342136e-19 1.93017423451248e-19 1.86019115913936e-19 1.7653743459392399e-19 1.64476248893172e-19 1.4985302253699057e-19 1.3286706629864939e-19 1.139754811718286e-19 9.403607252637179e-20 7.452364395387599e-20 5.784322279963859e-20 4.71361967899434e-20 3.66094156515732e-20 2.2547431770281997e-20 2.86562108403972e-21 -2.66142367203642e-20 -2.18979093628584e-19 ] } }