{ "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" [ "Co" "Co" "Co" "Co" ] } "a" { "source-value" [ 5.31598 4.95979 4.739038 4.57865 4.452604 4.348757 4.260448 4.183626 4.115644 4.054677 3.99941 3.948869 3.902308 3.859146 3.818921 3.781258 3.745851 3.712443 3.680822 3.650806 3.62224 3.59499 3.568941 3.54399 3.527004 3.509127 3.49026 3.470288 3.449072 3.426447 3.402214 3.376124 3.347871 3.317063 3.28319 3.245577 3.203292 3.155009 3.09874 3.031309 2.947164 2.83519 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.31598e-10 4.95979e-10 4.739038e-10 4.57865e-10 4.452604e-10 4.3487570000000003e-10 4.2604480000000004e-10 4.1836260000000004e-10 4.115644e-10 4.054677e-10 3.99941e-10 3.948869e-10 3.902308e-10 3.8591460000000003e-10 3.818921e-10 3.7812579999999997e-10 3.7458510000000004e-10 3.7124430000000003e-10 3.680822e-10 3.6508060000000003e-10 3.6222400000000005e-10 3.5949900000000004e-10 3.568941e-10 3.5439900000000003e-10 3.527004e-10 3.509127e-10 3.4902600000000005e-10 3.470288e-10 3.4490720000000004e-10 3.426447e-10 3.402214e-10 3.3761240000000003e-10 3.347871e-10 3.3170630000000005e-10 3.28319e-10 3.245577e-10 3.2032919999999997e-10 3.155009e-10 3.0987399999999997e-10 3.031309e-10 2.947164e-10 2.83519e-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" [ 0.964203 1.46664 1.88477 2.23263 2.53158 2.79193 3.02294 3.23084 3.41888 3.58745 3.73582 3.86428 3.97367 4.066 4.14324 4.20724 4.25966 4.30198 4.33549 4.36138 4.38056 4.39352 4.40065 4.40222 4.40059 4.39556 4.38682 4.37349 4.35449 4.32832 4.29284 4.24535 4.18219 4.09827 3.98628 3.83537 3.6286 3.3371 2.90913 2.24433 1.13171 -0.96312 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5448235043052226e-19 2.349816319130112e-19 3.019734429585216e-19 3.577067588896704e-19 4.056038289684864e-19 4.473164972910144e-19 4.843283794081153e-19 5.176376313545473e-19 5.477649605320705e-19 5.747728518288961e-19 5.985443463517056e-19 6.191259072225024e-19 6.366521172774336e-19 6.514450140172801e-19 6.638202262363392e-19 6.740741566094592e-19 6.824727664556928e-19 6.892531779149185e-19 6.946220717712193e-19 6.987701070424703e-19 7.018430818011649e-19 7.039195027017216e-19 7.05061854632352e-19 7.0531339636181765e-19 7.050522415726273e-19 7.042463467323648e-19 7.028460443657857e-19 7.007103429302593e-19 6.976662073507392e-19 6.934733111341056e-19 6.877887884835072e-19 6.801800517113281e-19 6.700607041743553e-19 6.566152379726017e-19 6.386724619962624e-19 6.144940146117696e-19 5.813658086234881e-19 5.34662360127168e-19 4.660940072867904e-19 3.5958130553600644e-19 1.8131993035255682e-19 -1.543088347024896e-19 ] } }