{ "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" [ 3.48051 3.247303 3.102771 2.99776 2.915235 2.847243 2.789424 2.739127 2.694618 2.6547 2.618516 2.585425 2.554941 2.526681 2.500345 2.475686 2.452504 2.430631 2.409928 2.390276 2.371572 2.353731 2.336676 2.32034 2.303825 2.286807 2.269252 2.251128 2.232395 2.213011 2.192929 2.172098 2.150458 2.127945 2.104486 2.079996 2.054382 2.027535 1.999331 1.969624 1.938247 1.904999 1.869643 1.831895 1.791406 1.747747 1.70038 1.648615 1.591551 1.527979 1.45622 1.373851 1.277178 1.16017 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.48051e-10 3.247303e-10 3.1027710000000005e-10 2.99776e-10 2.915235e-10 2.8472430000000005e-10 2.789424e-10 2.739127e-10 2.694618e-10 2.6547e-10 2.618516e-10 2.585425e-10 2.554941e-10 2.526681e-10 2.500345e-10 2.475686e-10 2.452504e-10 2.430631e-10 2.409928e-10 2.390276e-10 2.371572e-10 2.353731e-10 2.3366760000000004e-10 2.3203399999999998e-10 2.3038249999999998e-10 2.2868070000000002e-10 2.2692519999999998e-10 2.251128e-10 2.232395e-10 2.213011e-10 2.192929e-10 2.172098e-10 2.150458e-10 2.127945e-10 2.1044860000000003e-10 2.079996e-10 2.054382e-10 2.027535e-10 1.999331e-10 1.969624e-10 1.938247e-10 1.904999e-10 1.869643e-10 1.831895e-10 1.7914060000000002e-10 1.747747e-10 1.70038e-10 1.648615e-10 1.591551e-10 1.527979e-10 1.45622e-10 1.373851e-10 1.277178e-10 1.1601699999999999e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.03785 1.42536 1.713 1.94265 2.13282 2.29375 2.43454 2.55806 2.66388 2.75571 2.83598 2.90614 2.96734 3.02051 3.06642 3.10574 3.13903 3.16676 3.18937 3.20722 3.22064 3.22991 3.23531 3.23706 3.23518 3.22905 3.21801 3.2013 3.17795 3.14678 3.1064 3.05512 2.99088 2.91123 2.81316 2.69294 2.54596 2.36637 2.14631 1.87486 1.53654 1.10868 0.557223 -0.170468 -1.15844 -2.54523 -4.56757 -7.64633 -12.5626 -20.8371 -35.5905 -63.5712 -119.935 -236.14 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.6628190195968998e-19 2.2836784870382397e-19 2.744528574042e-19 3.1124684380401e-19 3.41715436852788e-19 3.6749926542375e-19 3.90056310253836e-19 4.098463960370039e-19 4.2680062917799195e-19 4.415134172080139e-19 4.54374089049132e-19 4.65614960313276e-19 4.75420281313356e-19 4.839390544763339e-19 4.91294647403028e-19 4.97594405927916e-19 5.02928051942502e-19 5.073708877485839e-19 5.109934091180579e-19 5.138532944097479e-19 5.160034154525759e-19 5.174886331922939e-19 5.18353808574654e-19 5.18634189485604e-19 5.18332980278412e-19 5.1735084600176995e-19 5.15582042997834e-19 5.129048058424199e-19 5.0916372340202995e-19 5.04169738833852e-19 4.977001495857599e-19 4.894841878066079e-19 4.79191805109792e-19 4.66430468219982e-19 4.50717921970344e-19 4.3145655447639597e-19 4.0790776230986395e-19 3.7913427213985793e-19 3.43876773132054e-19 3.00385688402124e-19 2.46180848520636e-19 1.7763011905831201e-19 8.92769670527382e-20 -2.73119846444712e-20 -1.8560254998909598e-19 -4.0779080341558198e-19 -7.318053928159379e-19 -1.2250771261853218e-18 -2.01275041822884e-18 -3.3384714740321396e-18 -5.702226749237699e-18 -1.0185229123534079e-17 -1.9215705459878998e-17 -3.7833799035275994e-17 ] } }