{ "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" [ 1.3302 1.85948 2.25796 2.58014 2.84965 3.07967 3.27847 3.45171 3.60342 3.73666 3.85378 3.95663 4.04674 4.12536 4.19353 4.25212 4.30192 4.34356 4.37762 4.4046 4.42496 4.43908 4.44732 4.45 4.44871 4.44445 4.43657 4.42422 4.40632 4.38149 4.34787 4.30301 4.24353 4.16475 4.05991 3.91905 3.72677 3.45821 3.07056 2.48364 1.5288 -0.218112 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.1312153585467998e-19 2.97921540739032e-19 3.61765075250664e-19 4.1338400204487597e-19 4.5656426450781e-19 4.93417531443078e-19 5.25268802926998e-19 5.53024910934414e-19 5.773315326488279e-19 5.98678934120244e-19 6.174436268576519e-19 6.33922013538342e-19 6.483592271873159e-19 6.609555398838239e-19 6.718775779978019e-19 6.812647308964079e-19 6.892435705337279e-19 6.95915034037704e-19 7.01372047653108e-19 7.0569472021164e-19 7.089567518384639e-19 7.112190252456719e-19 7.1253921879208805e-19 7.1296860213e-19 7.1276192134421395e-19 7.120793940981299e-19 7.108168789105379e-19 7.088381907675479e-19 7.05970294592688e-19 7.01992090010466e-19 6.96605572166958e-19 6.894182077868339e-19 6.798884611678019e-19 6.672665136451499e-19 6.50469293814294e-19 6.279010337477699e-19 5.97094381429218e-19 5.54066325746514e-19 4.91957948529504e-19 3.9792299752677595e-19 2.4494076380591998e-19 -3.4945394999500796e-20 ] } }