{ "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" [ "As" "As" ] } "a" { "source-value" [ 4.94179 4.610672 4.405459 4.256361 4.139187 4.04265 3.960556 3.889142 3.825946 3.769269 3.717893 3.670909 3.627626 3.587503 3.550109 3.515097 3.482182 3.451126 3.421731 3.393827 3.367272 3.34194 3.317724 3.29453 3.27874 3.262121 3.244582 3.226016 3.206293 3.185261 3.162733 3.13848 3.112215 3.083575 3.052087 3.017121 2.977813 2.932928 2.88062 2.817935 2.739713 2.63562 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.94179e-10 4.6106720000000003e-10 4.405459e-10 4.2563610000000004e-10 4.139187e-10 4.04265e-10 3.960556e-10 3.889142e-10 3.8259460000000004e-10 3.769269e-10 3.717893e-10 3.670909e-10 3.627626e-10 3.587503e-10 3.550109e-10 3.515097e-10 3.482182e-10 3.451126e-10 3.4217309999999997e-10 3.393827e-10 3.3672719999999997e-10 3.3419400000000005e-10 3.317724e-10 3.29453e-10 3.27874e-10 3.262121e-10 3.244582e-10 3.226016e-10 3.206293e-10 3.1852610000000003e-10 3.162733e-10 3.13848e-10 3.112215e-10 3.0835750000000004e-10 3.052087e-10 3.017121e-10 2.977813e-10 2.932928e-10 2.88062e-10 2.817935e-10 2.7397130000000004e-10 2.63562e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0.0124545 0.420008 0.914694 1.30375 1.5847 1.77757 1.90198 1.97858 2.04379 2.10304 2.15862 2.2103 2.25708 2.29811 2.33282 2.36088 2.3822 2.39694 2.40542 2.40813 2.40687 2.40283 2.3956 2.38474 2.36979 2.34991 2.32292 2.28666 2.23822 2.17351 2.08662 1.96866 1.80579 1.57534 1.2377 0.717508 -0.146732 -1.77019 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 1.99543087237536e-21 6.729269981489664e-20 1.4655013419860353e-19 2.088837769368e-19 2.5389692909817603e-19 2.847981095835456e-19 3.0473078892291843e-19 3.170034618382464e-19 3.274512555824832e-19 3.3694415206072323e-19 3.458490497191296e-19 3.5412909849542403e-19 3.6162408072752645e-19 3.681978114026688e-19 3.737589664534656e-19 3.782546740514304e-19 3.8167051460697604e-19 3.840321229460352e-19 3.853907687204736e-19 3.858249585847104e-19 3.8562308433048964e-19 3.849758049756864e-19 3.8381743127884804e-19 3.820774674686592e-19 3.7968221342056324e-19 3.764970862984128e-19 3.721728115988736e-19 3.663633191718528e-19 3.586023756206976e-19 3.482346907075008e-19 3.343133780493696e-19 3.1541410263041283e-19 2.893194520074432e-19 2.523972917811072e-19 1.98301400356416e-19 1.1495745428369666e-19 -2.350905799232256e-20 -2.836157032373952e-19 ] } }