{ "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" [ 8.37388 7.8128 7.465065 7.212417 7.013866 6.850282 6.711175 6.590163 6.483076 6.387038 6.299981 6.220366 6.147023 6.079034 6.01567 5.956342 5.900567 5.847943 5.798132 5.75085 5.705852 5.662927 5.621893 5.58259 5.555833 5.527673 5.497954 5.466493 5.433073 5.397434 5.35926 5.318163 5.273658 5.225128 5.171772 5.112522 5.045914 4.969858 4.881221 4.775002 4.642455 4.46607 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.37388e-10 7.8128e-10 7.465065000000001e-10 7.212417e-10 7.013866e-10 6.850282e-10 6.711175e-10 6.590163e-10 6.483076e-10 6.387038e-10 6.299981e-10 6.220366e-10 6.147023e-10 6.079034e-10 6.01567e-10 5.956342e-10 5.900567e-10 5.847943e-10 5.798132e-10 5.75085e-10 5.705852e-10 5.662927e-10 5.621893e-10 5.58259e-10 5.555833e-10 5.527673e-10 5.497954e-10 5.466493e-10 5.433073e-10 5.397434e-10 5.35926e-10 5.318163e-10 5.273658e-10 5.225128e-10 5.171772e-10 5.112522e-10 5.045914e-10 4.969858000000001e-10 4.881221e-10 4.775002e-10 4.6424550000000004e-10 4.4660700000000005e-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" [ 0.554163 0.749215 0.899378 1.02357 1.12982 1.22246 1.30417 1.37673 1.44141 1.49917 1.55075 1.59673 1.63758 1.67369 1.70541 1.733 1.75671 1.77677 1.79334 1.80661 1.81671 1.82378 1.82794 1.82931 1.82864 1.82644 1.82235 1.81588 1.80645 1.79326 1.77527 1.75104 1.71862 1.67522 1.61683 1.53738 1.42743 1.27141 1.0421 0.687477 0.0955983 -1.02278 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 8.878670100273419e-20 1.2003747668423098e-19 1.4409624167336519e-19 1.63993993726338e-19 1.81017120462588e-19 1.95859684799964e-19 2.08951070076378e-19 2.20576463732682e-19 2.30939342201394e-19 2.4019351443937797e-19 2.4845754151755e-19 2.5582434968068197e-19 2.62369241230572e-19 2.6815470105594595e-19 2.73236805338994e-19 2.7765721067219998e-19 2.81455971471414e-19 2.8466993779921797e-19 2.8732474448175596e-19 2.8945083287507397e-19 2.91069031275414e-19 2.9220177015565197e-19 2.9286827563539597e-19 2.93087773834254e-19 2.9298042799977597e-19 2.92627949140296e-19 2.9197265889698996e-19 2.90936050614792e-19 2.8942519804892994e-19 2.87311927068684e-19 2.8442961130411795e-19 2.8054753731993595e-19 2.75353280672508e-19 2.6839983408094795e-19 2.5904472471502196e-19 2.46315431357892e-19 2.2869949926706197e-19 2.0370233942339398e-19 1.6696282702914e-19 1.101459585812418e-19 1.5316536251012218e-20 -1.63867421772252e-19 ] } }