{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Ni" ] } "a" { "source-value" [ 3.48207 3.248758 3.104161 2.999104 2.916541 2.848519 2.790674 2.740355 2.695825 2.65589 2.619689 2.586584 2.556086 2.527814 2.501466 2.476796 2.453603 2.43172 2.411008 2.391347 2.372635 2.354786 2.337723 2.32138 2.304858 2.287832 2.27027 2.252137 2.233396 2.214003 2.193912 2.173071 2.151422 2.128899 2.105429 2.080928 2.055303 2.028444 2.000227 1.970507 1.939116 1.905853 1.870481 1.832716 1.792209 1.748531 1.701142 1.649354 1.592264 1.528664 1.456873 1.374466 1.277751 1.16069 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.4820700000000006e-10 3.248758e-10 3.104161e-10 2.999104e-10 2.9165410000000004e-10 2.848519e-10 2.790674e-10 2.7403550000000003e-10 2.6958250000000004e-10 2.65589e-10 2.6196890000000004e-10 2.586584e-10 2.5560860000000003e-10 2.527814e-10 2.501466e-10 2.4767960000000004e-10 2.453603e-10 2.43172e-10 2.4110079999999997e-10 2.3913470000000003e-10 2.372635e-10 2.354786e-10 2.337723e-10 2.3213800000000002e-10 2.304858e-10 2.287832e-10 2.2702700000000002e-10 2.2521369999999998e-10 2.233396e-10 2.214003e-10 2.1939120000000003e-10 2.1730710000000003e-10 2.1514220000000002e-10 2.1288990000000002e-10 2.105429e-10 2.0809280000000002e-10 2.055303e-10 2.028444e-10 2.0002270000000003e-10 1.970507e-10 1.9391160000000002e-10 1.905853e-10 1.870481e-10 1.832716e-10 1.792209e-10 1.748531e-10 1.701142e-10 1.649354e-10 1.592264e-10 1.528664e-10 1.456873e-10 1.374466e-10 1.277751e-10 1.1606900000000001e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.0608195 0.301407 0.534537 0.743412 0.927443 1.08556 1.21485 1.32069 1.40776 1.48119 1.54606 1.60629 1.66403 1.71981 1.77313 1.82303 1.86853 1.90889 1.94369 1.97275 1.99615 2.01339 2.02311 2.02617 2.02303 2.01315 1.99568 1.96951 1.93323 1.88504 1.82266 1.7432 1.64307 1.51771 1.3614 1.16685 0.924778 0.621969 0.240153 -0.241499 -0.851076 -1.62715 -2.6231 -3.91315 -5.65682 -8.13683 -11.7839 -17.3486 -26.6611 -42.7142 -70.3715 -123.07 -245.846 -626.983 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 9.7443581791563e-21 4.8290725272403793e-20 8.56422691408458e-20 1.1910773358352078e-19 1.485927503966862e-19 1.73925886680504e-19 1.9464042838148997e-19 2.1159786587574597e-19 2.25548017827984e-19 2.37312800851446e-19 2.4770612067620396e-19 2.5735603054278597e-19 2.66606998427502e-19 2.75543939691954e-19 2.84086745504442e-19 2.9208160690810197e-19 2.9937151059280196e-19 3.0583789548762597e-19 3.11413470173946e-19 3.1606939547234996e-19 3.1981848879591e-19 3.2258064131292596e-19 3.24137957001174e-19 3.24628223051178e-19 3.2412513958810195e-19 3.2254218907371e-19 3.1974318649411195e-19 3.15550290242934e-19 3.09737593414782e-19 3.02016704215536e-19 2.92022326372644e-19 2.7929143083888e-19 2.6324883620263796e-19 2.43163949918814e-19 2.1812032695275995e-19 1.8694998053828998e-19 1.481657703237252e-19 9.965041988723459e-20 3.84767525185002e-20 -3.8692405493436593e-20 -1.363574080958184e-19 -2.6069817100131e-19 -4.2026695286453995e-19 -6.2695574953371e-19 -9.063224826743879e-19 -1.3036638900830218e-18 -1.8879889237392596e-18 -2.77955215526124e-18 -4.27157914567374e-18 -6.8435693180002795e-18 -1.1274757299953098e-17 -1.9717987834637996e-17 -3.93888716762364e-17 -1.0045375125152218e-16 ] } }