{ "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" [ "Sn" "Sn" "Sn" "Sn" ] } "a" { "source-value" [ 7.19052 6.708729 6.410134 6.193188 6.022696 5.882229 5.762779 5.658868 5.566914 5.484448 5.409693 5.341329 5.27835 5.219969 5.165559 5.114615 5.066722 5.021534 4.978763 4.938162 4.899523 4.862664 4.827429 4.79368 4.770704 4.746524 4.721004 4.693989 4.665292 4.634689 4.60191 4.566621 4.528405 4.486732 4.440916 4.390039 4.332844 4.267535 4.191424 4.100215 3.986399 3.83494 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.19052e-10 6.708729e-10 6.410134000000001e-10 6.193188e-10 6.022696e-10 5.882229e-10 5.762779000000001e-10 5.658868e-10 5.566914e-10 5.484448000000001e-10 5.409693e-10 5.341329e-10 5.27835e-10 5.219969e-10 5.165559000000001e-10 5.114615e-10 5.066722e-10 5.021534e-10 4.978763e-10 4.938162e-10 4.899523000000001e-10 4.862664e-10 4.827429e-10 4.793680000000001e-10 4.770704e-10 4.746524e-10 4.721004e-10 4.693989e-10 4.665292e-10 4.634689e-10 4.6019100000000005e-10 4.566621e-10 4.528405e-10 4.486732e-10 4.4409159999999996e-10 4.390039e-10 4.332844e-10 4.267535e-10 4.1914239999999995e-10 4.1002150000000006e-10 3.986399e-10 3.83494e-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" [ 0 0.574294 1.19332 1.43123 1.63976 1.82442 1.98895 2.13605 2.26778 2.38576 2.49127 2.5854 2.66905 2.74297 2.80783 2.8642 2.91259 2.95344 2.98715 3.01407 3.03454 3.04885 3.05725 3.06 3.05866 3.05425 3.04603 3.0331 3.01428 2.988 2.95224 2.90424 2.8402 2.75479 2.64032 2.4853 2.2719 1.97106 1.53231 0.860328 -0.247312 -2.30456 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 9.201204278463959e-20 1.9119094208848797e-19 2.29308326387982e-19 2.62718515736784e-19 2.9230430946022796e-19 3.1866492161942996e-19 3.4223293990557e-19 3.63338412705252e-19 3.82240892633184e-19 3.99145458298518e-19 4.1422674695435997e-19 4.2762895449776997e-19 4.39472244176298e-19 4.49863961824422e-19 4.588954315102799e-19 4.66648364242206e-19 4.73193255792096e-19 4.7859419322531e-19 4.82907252724038e-19 4.861869082938359e-19 4.8847962305709e-19 4.898254514296499e-19 4.90266050004e-19 4.90051358335044e-19 4.8934479843945e-19 4.88027809246302e-19 4.859561948585399e-19 4.829408984333519e-19 4.787303782392e-19 4.73000994596016e-19 4.65310546752816e-19 4.550502075886799e-19 4.413660169576859e-19 4.2302590102828796e-19 3.9818895884802e-19 3.6399850947846e-19 3.15798627621204e-19 2.45503127804454e-19 1.3783974191759518e-19 -3.96237507707808e-20 -3.6923121836510396e-19 ] } }