{ "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" [ "Cr" "Cr" ] } "a" { "source-value" [ 4.3269 4.036982 3.857302 3.726755 3.624161 3.539635 3.467756 3.405228 3.349894 3.30027 3.255286 3.214148 3.176251 3.14112 3.108379 3.077723 3.048903 3.021711 2.995974 2.971542 2.948291 2.926111 2.904908 2.8846 2.864069 2.842912 2.821089 2.798557 2.775269 2.751171 2.726206 2.700308 2.673406 2.645419 2.616254 2.585809 2.553966 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.3269000000000003e-10 4.036982e-10 3.857302e-10 3.726755e-10 3.624161e-10 3.539635e-10 3.467756e-10 3.4052280000000004e-10 3.349894e-10 3.3002699999999997e-10 3.255286e-10 3.214148e-10 3.176251e-10 3.14112e-10 3.108379e-10 3.077723e-10 3.048903e-10 3.021711e-10 2.995974e-10 2.971542e-10 2.9482910000000003e-10 2.926111e-10 2.904908e-10 2.8846e-10 2.8640690000000004e-10 2.8429120000000003e-10 2.8210890000000003e-10 2.7985570000000003e-10 2.775269e-10 2.751171e-10 2.726206e-10 2.7003080000000005e-10 2.673406e-10 2.645419e-10 2.6162540000000004e-10 2.585809e-10 2.553966e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.934434 1.38479 1.74187 2.03996 2.30284 2.55584 2.80735 3.02835 3.19493 3.31767 3.4181 3.50806 3.59046 3.66562 3.7345 3.79873 3.85959 3.91701 3.96943 4.0145 4.05007 4.075 4.08927 4.09374 4.08931 4.07584 4.05286 4.01933 3.97337 3.91223 3.83244 3.72995 3.6002 3.43798 3.23719 2.99043 2.68838 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4971283208151558e-19 2.2186781809968596e-19 2.7907834134655797e-19 3.26837624629464e-19 3.68955643984056e-19 4.0949071282425596e-19 4.4978705734599e-19 4.8519516095739e-19 5.11884219326562e-19 5.31549335332278e-19 5.476399952675399e-19 5.62053176267004e-19 5.75255111731164e-19 5.87297071312308e-19 5.983328639673e-19 6.08623644487482e-19 6.183744914820059e-19 6.27574189714434e-19 6.359727996298619e-19 6.431938097193e-19 6.488927520064379e-19 6.52886978355e-19 6.55173284411718e-19 6.558894573671161e-19 6.55179693118254e-19 6.53021561192256e-19 6.49339759287324e-19 6.43967661033522e-19 6.36604057223658e-19 6.268083492833819e-19 6.1402458192069595e-19 5.9760387359883e-19 5.768156317726799e-19 5.50825122415932e-19 5.18655017781846e-19 4.79119707161262e-19 4.3072596193129196e-19 ] } }