{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Cu" "Cu" ] } "a" { "source-value" [ 4.29702 4.009104 3.830665 3.701019 3.599134 3.515192 3.443809 3.381712 3.326761 3.27748 3.232806 3.191953 3.154317 3.119428 3.086913 3.056469 3.027849 3.000845 2.975285 2.951022 2.927931 2.905905 2.884848 2.86468 2.85095 2.8365 2.821249 2.805105 2.787956 2.769668 2.750079 2.72899 2.706152 2.681249 2.653869 2.623466 2.589286 2.550258 2.504774 2.450268 2.382251 2.29174 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.29702e-10 4.009104e-10 3.830665e-10 3.7010190000000003e-10 3.599134e-10 3.515192e-10 3.443809e-10 3.381712e-10 3.326761e-10 3.27748e-10 3.2328060000000003e-10 3.191953e-10 3.154317e-10 3.119428e-10 3.086913e-10 3.056469e-10 3.0278489999999997e-10 3.000845e-10 2.975285e-10 2.951022e-10 2.9279310000000004e-10 2.9059050000000003e-10 2.884848e-10 2.86468e-10 2.8509500000000004e-10 2.8365e-10 2.821249e-10 2.8051050000000005e-10 2.787956e-10 2.769668e-10 2.750079e-10 2.72899e-10 2.706152e-10 2.681249e-10 2.653869e-10 2.6234660000000003e-10 2.589286e-10 2.550258e-10 2.504774e-10 2.450268e-10 2.382251e-10 2.29174e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.18646 1.57174 1.86019 2.09405 2.29098 2.46043 2.60817 2.73804 2.85278 2.95439 3.04445 3.12417 3.19454 3.25639 3.31039 3.35713 3.3971 3.43073 3.45841 3.48047 3.4972 3.50887 3.51571 3.51795 3.51686 3.51328 3.50662 3.49615 3.48092 3.45967 3.43078 3.39203 3.34036 3.2715 3.17925 3.05439 2.88253 2.64024 2.28673 1.74478 0.849773 -0.81834 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.90091848917564e-19 2.5182051027231597e-19 2.98035295280046e-19 3.3550379804277e-19 3.6705546249613197e-19 3.94204345559262e-19 4.1787490314997793e-19 4.386823710957359e-19 4.5706574579425195e-19 4.73345462572326e-19 4.877746653381299e-19 5.00547217464378e-19 5.11821734437836e-19 5.21731196919126e-19 5.303829507427259e-19 5.37871524330042e-19 5.4427542433614e-19 5.49663544356282e-19 5.54098369279194e-19 5.57632770933798e-19 5.603132124424799e-19 5.62182952574358e-19 5.63278841392014e-19 5.636377289580299e-19 5.634630917049239e-19 5.628895124699519e-19 5.618224628317079e-19 5.6014498389591e-19 5.57704868882328e-19 5.543002435350779e-19 5.49671555239452e-19 5.43463120782702e-19 5.35184674114824e-19 5.241520858131e-19 5.0937200636445e-19 4.89367228912326e-19 4.61832221280402e-19 4.2301308361521597e-19 3.66374537426682e-19 2.7954457474705197e-19 1.3614864448040818e-19 -1.31112522666756e-19 ] } }