{ "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" [ "Mg" "Mg" "Mg" "Mg" ] } "a" { "source-value" [ 6.75864 6.305786 6.025125 5.82121 5.660958 5.528928 5.416653 5.318983 5.232552 5.155039 5.084774 5.020516 4.96132 4.906445 4.855303 4.807419 4.762402 4.719929 4.679726 4.641565 4.605246 4.570601 4.537482 4.50576 4.473691 4.440643 4.406556 4.371361 4.334984 4.297343 4.258347 4.217896 4.175875 4.132158 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.75864e-10 6.305786000000001e-10 6.025125e-10 5.82121e-10 5.660958e-10 5.528928e-10 5.416653e-10 5.318983000000001e-10 5.232552e-10 5.155039e-10 5.084774000000001e-10 5.020516e-10 4.96132e-10 4.906445e-10 4.855303000000001e-10 4.807419e-10 4.762402e-10 4.719928999999999e-10 4.679726e-10 4.641565e-10 4.6052460000000005e-10 4.570601e-10 4.537482e-10 4.505760000000001e-10 4.473691e-10 4.440643e-10 4.4065560000000005e-10 4.3713610000000005e-10 4.3349840000000006e-10 4.297343e-10 4.2583469999999996e-10 4.217896e-10 4.175875e-10 4.1321580000000005e-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" [ 0.434544 0.637633 0.74552 0.828139 0.907021 0.98179 1.05314 1.13491 1.19555 1.24477 1.2863 1.32145 1.35147 1.37731 1.39957 1.41862 1.43469 1.44806 1.46129 1.47391 1.48364 1.49024 1.49397 1.49514 1.49398 1.49038 1.48382 1.47342 1.45807 1.43644 1.40691 1.36754 1.31664 1.25455 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 6.962162432448959e-20 1.0216006936673219e-19 1.19445472417968e-19 1.3268249555041258e-19 1.4532078527473138e-19 1.57300099749486e-19 1.68731630033076e-19 1.81832628369294e-19 1.9154822747786996e-19 1.9943414087041797e-19 2.0608798043141998e-19 2.1171963129993e-19 2.1652936555519797e-19 2.20669389977454e-19 2.24235835164738e-19 2.27287981652508e-19 2.29862679503346e-19 2.32004789663004e-19 2.3412446934978597e-19 2.36146416261894e-19 2.37705334126776e-19 2.3876277070521597e-19 2.39360382589698e-19 2.39547837255876e-19 2.39361984766332e-19 2.3878520117809197e-19 2.3773417330618796e-19 2.3606790960682797e-19 2.33608568473638e-19 2.3014306041429597e-19 2.25411832814094e-19 2.1910406340603597e-19 2.10948984338976e-19 2.0100106961847e-19 ] } }