{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Cu" ] } "a" { "source-value" [ 3.58928 3.348784 3.199735 3.091442 3.006337 2.936221 2.876595 2.824726 2.778825 2.73766 2.700345 2.66622 2.634783 2.60564 2.578481 2.553051 2.529144 2.506588 2.485238 2.464971 2.445684 2.427285 2.409696 2.39285 2.375819 2.358269 2.340166 2.321476 2.302157 2.282168 2.261458 2.239976 2.21766 2.194444 2.170251 2.144996 2.118582 2.090896 2.061811 2.031176 1.998818 1.964531 1.928071 1.889143 1.847389 1.802367 1.753519 1.700137 1.64129 1.575731 1.50173 1.416787 1.317094 1.19643 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.58928e-10 3.3487840000000004e-10 3.199735e-10 3.0914419999999997e-10 3.006337e-10 2.936221e-10 2.876595e-10 2.824726e-10 2.778825e-10 2.73766e-10 2.700345e-10 2.66622e-10 2.6347830000000003e-10 2.60564e-10 2.578481e-10 2.553051e-10 2.529144e-10 2.5065879999999997e-10 2.485238e-10 2.464971e-10 2.445684e-10 2.427285e-10 2.4096959999999997e-10 2.39285e-10 2.375819e-10 2.358269e-10 2.340166e-10 2.3214760000000003e-10 2.3021569999999998e-10 2.282168e-10 2.2614580000000002e-10 2.239976e-10 2.21766e-10 2.194444e-10 2.170251e-10 2.144996e-10 2.118582e-10 2.090896e-10 2.0618110000000002e-10 2.031176e-10 1.9988180000000002e-10 1.964531e-10 1.928071e-10 1.889143e-10 1.847389e-10 1.8023670000000002e-10 1.753519e-10 1.700137e-10 1.64129e-10 1.575731e-10 1.50173e-10 1.416787e-10 1.317094e-10 1.19643e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.771898 1.19199 1.50981 1.75909 1.96014 2.12693 2.26931 2.39253 2.49978 2.59356 2.67582 2.74804 2.81133 2.86667 2.91491 2.9568 2.99292 3.02369 3.04939 3.07021 3.0863 3.09774 3.10458 3.10686 3.10435 3.09616 3.08117 3.05825 3.02627 2.9841 2.93043 2.86345 2.78061 2.67837 2.55197 2.39537 2.20128 1.96131 1.6654 1.2999 0.844826 0.270943 -0.463577 -1.41866 -2.68145 -4.37861 -6.7015 -9.95103 -14.601 -21.4799 -32.1623 -49.9432 -82.748 -153.447 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.236716939431332e-19 1.90977852596166e-19 2.41898230377954e-19 2.81837289510306e-19 3.1404905073687596e-19 3.40771754815362e-19 3.6358354573025396e-19 3.8332556621440194e-19 4.0050891061405195e-19 4.15534123087704e-19 4.2871362807898793e-19 4.40284547729736e-19 4.50424723646322e-19 4.59291169138878e-19 4.67020069221294e-19 4.737315871411199e-19 4.79518649143128e-19 4.84448546645946e-19 4.88566140595326e-19 4.919018723473139e-19 4.944797745514199e-19 4.96312664620716e-19 4.974085534383719e-19 4.97773849710924e-19 4.9737170337579e-19 4.960595207125439e-19 4.93657857938178e-19 4.8998566909305e-19 4.84861908217518e-19 4.7810552935194e-19 4.69506647357262e-19 4.587752682627299e-19 4.45502837026674e-19 4.29122183120658e-19 4.0887067046689796e-19 3.83780584378458e-19 3.52683938089152e-19 3.14236505403054e-19 2.6682649662636e-19 2.0826694065365999e-19 1.353560476995684e-19 4.3409854374586196e-20 -7.427322374598179e-20 -2.27294390359044e-19 -4.2961565352392996e-19 -7.01530663139874e-19 -1.0736986712751e-18 -1.5943307750233018e-18 -2.3393381033034e-18 -3.44145938806566e-18 -5.15296855556982e-18 -8.001782806718879e-18 -1.32576912110232e-17 -2.4584919795739798e-17 ] } }