{ "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" [ 5.28 4.92622 4.706962 4.547659 4.422466 4.319322 4.23161 4.155308 4.087786 4.027231 3.972338 3.922139 3.875893 3.833024 3.793071 3.755663 3.720495 3.687313 3.655906 3.626094 3.597721 3.570655 3.544782 3.52 3.503129 3.485373 3.466634 3.446797 3.425725 3.403253 3.379184 3.353271 3.325209 3.294609 3.260967 3.223608 3.18161 3.133653 3.077765 3.010791 2.927216 2.816 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.28e-10 4.92622e-10 4.706962e-10 4.5476590000000006e-10 4.422466e-10 4.319322e-10 4.23161e-10 4.155308e-10 4.0877860000000003e-10 4.027231e-10 3.972338e-10 3.9221390000000004e-10 3.8758930000000004e-10 3.833024e-10 3.793071e-10 3.7556630000000004e-10 3.720495e-10 3.6873130000000003e-10 3.655906e-10 3.626094e-10 3.597721e-10 3.570655e-10 3.5447820000000005e-10 3.52e-10 3.503129e-10 3.4853730000000004e-10 3.466634e-10 3.446797e-10 3.425725e-10 3.403253e-10 3.379184e-10 3.3532710000000003e-10 3.3252090000000003e-10 3.294609e-10 3.260967e-10 3.223608e-10 3.18161e-10 3.133653e-10 3.077765e-10 3.0107910000000003e-10 2.927216e-10 2.816e-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" [ 1.30765 1.83694 2.23541 2.55759 2.82711 3.05712 3.25593 3.42916 3.58088 3.71411 3.83123 3.93408 4.0242 4.10281 4.17098 4.22958 4.27937 4.32101 4.35507 4.38206 4.40241 4.41653 4.42477 4.42745 4.42616 4.4219 4.41402 4.40167 4.38378 4.35894 4.32532 4.28046 4.22098 4.1422 4.03737 3.8965 3.70423 3.43567 3.04801 2.4611 1.50625 -0.240659 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.09508625818912e-19 2.943102321812352e-19 3.581521639902528e-19 4.097710903591872e-19 4.529529546429888e-19 4.898046190980096e-19 5.216574924961345e-19 5.494119980982529e-19 5.737202217890305e-19 5.950660209079488e-19 6.138307134907585e-19 6.303091000356864e-19 6.447479157423361e-19 6.573426261584448e-19 6.682646641824385e-19 6.776534191803265e-19 6.856306565752897e-19 6.923021200243009e-19 6.977591335947458e-19 7.020834082942849e-19 7.053438377176128e-19 7.076061111061824e-19 7.0892630464172155e-19 7.093556879760961e-19 7.091490071920129e-19 7.08466479951552e-19 7.072039647743616e-19 7.052252766476736e-19 7.023589826730624e-19 6.983791759469951e-19 6.929926581478655e-19 6.858052938269568e-19 6.762755472864384e-19 6.63653599867776e-19 6.468579823519297e-19 6.242881202947201e-19 5.934830704065984e-19 5.504550150783936e-19 4.883450361964609e-19 3.9431168814508804e-19 2.4132785350800005e-19 -3.855782233851072e-20 ] } }