{ "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" [ 5.42254 5.05921 4.834033 4.67043 4.541858 4.435929 4.345849 4.267487 4.198143 4.135953 4.079579 4.028024 3.980531 3.936504 3.895472 3.857054 3.820937 3.78686 3.754605 3.723987 3.694849 3.667053 3.640481 3.61503 3.597704 3.579468 3.560223 3.53985 3.518209 3.495131 3.470411 3.443799 3.414979 3.383553 3.349002 3.310634 3.267502 3.218251 3.160854 3.092071 3.006239 2.89202 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.42254e-10 5.059210000000001e-10 4.834033e-10 4.67043e-10 4.5418580000000007e-10 4.435929e-10 4.345849e-10 4.267487e-10 4.198143e-10 4.135953e-10 4.079579e-10 4.0280240000000004e-10 3.9805310000000004e-10 3.936504e-10 3.895472e-10 3.8570540000000004e-10 3.820937e-10 3.78686e-10 3.754605e-10 3.7239870000000003e-10 3.694849e-10 3.667053e-10 3.640481e-10 3.61503e-10 3.597704e-10 3.579468e-10 3.5602230000000004e-10 3.53985e-10 3.518209e-10 3.495131e-10 3.470411e-10 3.4437989999999997e-10 3.414979e-10 3.383553e-10 3.349002e-10 3.310634e-10 3.267502e-10 3.218251e-10 3.160854e-10 3.0920709999999997e-10 3.006239e-10 2.89202e-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" [ 0.899262 1.34422 1.6822 1.95617 2.18547 2.38118 2.55029 2.69752 2.82626 2.9393 3.03846 3.12548 3.20154 3.26787 3.32521 3.37452 3.41631 3.45116 3.47969 3.50224 3.51919 3.53095 3.53781 3.54005 3.53897 3.53543 3.52893 3.51876 3.50402 3.4836 3.456 3.41928 3.37069 3.30652 3.22139 3.10743 2.95256 2.73737 2.42888 1.9656 1.22063 -0.119563 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4407765523738496e-19 2.153677857211776e-19 2.69518151150976e-19 3.1341298403103363e-19 3.5015089394597763e-19 3.8150709259165445e-19 4.0860150142600324e-19 4.321903478140416e-19 4.528167696302209e-19 4.70927774151744e-19 4.868149575235969e-19 5.007570984777984e-19 5.129432538556033e-19 5.235704913813696e-19 5.327573721250369e-19 5.406577050422016e-19 5.473532011405249e-19 5.529367866640128e-19 5.575077965631553e-19 5.611207048430592e-19 5.638363942153152e-19 5.65720553921376e-19 5.668196470832448e-19 5.671785346463041e-19 5.670054995712576e-19 5.664383290474944e-19 5.653969142439744e-19 5.637675006206208e-19 5.614058922815617e-19 5.581342476218881e-19 5.5371224014848e-19 5.478290475969024e-19 5.400440713964353e-19 5.297629040207616e-19 5.161235744478913e-19 4.978651696772544e-19 4.7305226035092485e-19 4.385750216479296e-19 3.891494750728704e-19 3.1492383658444804e-19 1.9556648486471043e-19 -1.915610433127104e-20 ] } }