{ "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" [ "Al" "Al" ] } "a" { "source-value" [ 4.72355 4.407054 4.210902 4.068388 3.956389 3.864114 3.785646 3.717385 3.656979 3.602806 3.553698 3.508789 3.467417 3.429066 3.393323 3.359857 3.328395 3.298711 3.270614 3.243943 3.21856 3.194347 3.1712 3.14903 3.133937 3.118052 3.101288 3.083542 3.06469 3.044587 3.023053 2.999871 2.974767 2.947392 2.917294 2.883873 2.8463 2.803398 2.7534 2.693483 2.618716 2.51922 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.723550000000001e-10 4.4070539999999995e-10 4.210902e-10 4.068388e-10 3.9563890000000005e-10 3.864114e-10 3.785646e-10 3.7173850000000004e-10 3.6569790000000004e-10 3.602806e-10 3.5536979999999997e-10 3.5087890000000004e-10 3.467417e-10 3.429066e-10 3.393323e-10 3.359857e-10 3.328395e-10 3.298711e-10 3.2706140000000004e-10 3.243943e-10 3.2185600000000003e-10 3.194347e-10 3.1712e-10 3.1490300000000004e-10 3.1339370000000003e-10 3.118052e-10 3.1012879999999997e-10 3.083542e-10 3.06469e-10 3.044587e-10 3.023053e-10 2.999871e-10 2.974767e-10 2.947392e-10 2.917294e-10 2.883873e-10 2.8463e-10 2.803398e-10 2.7534e-10 2.6934830000000003e-10 2.618716e-10 2.51922e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.45685 1.8025 1.98679 2.18093 2.35801 2.51235 2.64554 2.76172 2.86202 2.9465 3.01535 3.06926 3.11156 3.14596 3.17529 3.20201 3.22605 3.24683 3.26414 3.27863 3.29061 3.29961 3.30525 3.30718 3.3062 3.30288 3.29657 3.2864 3.27124 3.24963 3.21963 3.1786 3.12384 3.05125 2.95386 2.82119 2.63854 2.38395 2.01985 1.472 0.573147 -1.10165 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.33413101001248e-19 2.887923358992e-19 3.1831884884392323e-19 3.4942350576013443e-19 3.7779484936126087e-19 4.0252284332668806e-19 4.238622337391232e-19 4.424763217195776e-19 4.585461532262015e-19 4.7208134131872e-19 4.83112327352928e-19 4.917496615156608e-19 4.985268686216448e-19 5.040383561971968e-19 5.087375402260032e-19 5.130185561567808e-19 5.16870188753184e-19 5.201995117712065e-19 5.2297287950181125e-19 5.252944334253505e-19 5.272138410170688e-19 5.286557999757888e-19 5.295594275899201e-19 5.298686476777344e-19 5.29711634368896e-19 5.291797117307905e-19 5.281687382830656e-19 5.26539324659712e-19 5.241104249025793e-19 5.206481212250304e-19 5.158415913626304e-19 5.09267860687488e-19 5.004943415119872e-19 4.888641414216e-19 4.732605433116288e-19 4.520044660834752e-19 4.227407101045632e-19 3.81950895515616e-19 3.23615644752288e-19 2.3584039858176e-19 9.182827236816575e-20 -1.76503787430432e-19 ] } }