{ "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" [ "Pb" "Pb" "Pb" "Pb" ] } "a" { "source-value" [ 7.43484 6.936678 6.627937 6.403621 6.227335 6.082096 5.958587 5.851146 5.756067 5.670799 5.593504 5.522817 5.457698 5.397333 5.341075 5.2884 5.238879 5.192156 5.147932 5.105952 5.066 5.027888 4.991456 4.95656 4.932804 4.907802 4.881415 4.853482 4.82381 4.792168 4.758275 4.721787 4.682273 4.639185 4.591812 4.539207 4.480069 4.412541 4.333845 4.239537 4.121854 3.96525 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.43484e-10 6.936678e-10 6.627937000000001e-10 6.403621e-10 6.227335000000001e-10 6.082096e-10 5.958586999999999e-10 5.851146e-10 5.756067e-10 5.670799e-10 5.593504000000001e-10 5.522817e-10 5.457698e-10 5.397333e-10 5.341075000000001e-10 5.2884e-10 5.238879e-10 5.192156e-10 5.147932e-10 5.105952e-10 5.066e-10 5.027888e-10 4.991456e-10 4.95656e-10 4.932804e-10 4.907802e-10 4.881415e-10 4.853482e-10 4.823810000000001e-10 4.792168e-10 4.758275e-10 4.721787e-10 4.682273e-10 4.639185e-10 4.5918120000000003e-10 4.5392070000000004e-10 4.4800690000000003e-10 4.412541e-10 4.3338450000000005e-10 4.2395370000000006e-10 4.121854e-10 3.9652500000000003e-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" [ 0.422048 0.626183 0.791003 0.937441 1.06435 1.17578 1.27433 1.36185 1.44085 1.51238 1.57618 1.63293 1.68317 1.72735 1.76589 1.7991 1.82731 1.85075 1.87202 1.88911 1.90213 1.91125 1.91663 1.91839 1.91753 1.91469 1.90939 1.90103 1.88883 1.87176 1.84845 1.81739 1.77618 1.72087 1.64626 1.5445 1.40336 1.20263 0.913897 0.469849 -0.275583 -1.69179 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 6.761954384553984e-20 1.0032557629424066e-19 1.2673265135826624e-19 1.501946053579373e-19 1.7052766863484798e-19 1.8838072272042242e-19 2.041701733184064e-19 2.18192423103648e-19 2.30849618407968e-19 2.4230998777655042e-19 2.525318746172544e-19 2.616242269402944e-19 2.6967356228319364e-19 2.76751978593888e-19 2.829267672904512e-19 2.88247595848128e-19 2.927673360954048e-19 2.9652283809456e-19 2.999306677670016e-19 3.026687876119488e-19 3.0475482157223043e-19 3.062160066504e-19 3.0707797767239043e-19 3.073599607576512e-19 3.072221735682624e-19 3.0676715540795524e-19 3.059180017989312e-19 3.0457858214394244e-19 3.026239266665664e-19 2.9988901117486084e-19 2.96154337471776e-19 2.9117797688757123e-19 2.845754070332544e-19 2.757137681436096e-19 2.637599283758208e-19 2.4745617908256e-19 2.248430582565888e-19 1.9268256694727043e-19 1.4642244072192576e-19 7.527810831062593e-20 -4.4153263968992644e-20 -2.710546385303232e-19 ] } }