{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Cu" "Cu" ] } "a" { "source-value" [ 4.30074 4.012575 3.833981 3.704223 3.60225 3.518235 3.44679 3.38464 3.329641 3.280317 3.235605 3.194716 3.157047 3.122129 3.089586 3.059115 3.03047 3.003443 2.97786 2.953577 2.930466 2.90842 2.887346 2.86716 2.846753 2.825724 2.804033 2.781637 2.75849 2.734538 2.709723 2.683983 2.657243 2.629425 2.600436 2.570176 2.538525 2.505351 2.4705 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.3007400000000003e-10 4.012575e-10 3.833981e-10 3.704223e-10 3.60225e-10 3.518235e-10 3.4467900000000004e-10 3.38464e-10 3.329641e-10 3.2803170000000003e-10 3.235605e-10 3.1947160000000003e-10 3.157047e-10 3.1221290000000005e-10 3.089586e-10 3.059115e-10 3.0304700000000003e-10 3.003443e-10 2.9778600000000003e-10 2.9535770000000004e-10 2.930466e-10 2.90842e-10 2.887346e-10 2.8671600000000004e-10 2.846753e-10 2.8257240000000003e-10 2.804033e-10 2.781637e-10 2.7584900000000003e-10 2.7345380000000004e-10 2.709723e-10 2.683983e-10 2.657243e-10 2.629425e-10 2.600436e-10 2.570176e-10 2.538525e-10 2.5053510000000004e-10 2.4705e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.910437 1.39849 1.75482 2.02817 2.24618 2.42877 2.5855 2.72137 2.84008 2.94442 3.03618 3.11635 3.18582 3.24572 3.29732 3.34174 3.37977 3.41189 3.43839 3.45953 3.47553 3.48664 3.49311 3.4952 3.49294 3.48559 3.47212 3.45134 3.42178 3.3817 3.32894 3.26079 3.17388 3.06395 2.9256 2.75204 2.53452 2.26179 1.91878 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.458680888129058e-19 2.2406280008826597e-19 2.8115316008758797e-19 3.2494865837797794e-19 3.5987771117581197e-19 3.8913185433601797e-19 4.142427687207e-19 4.360115426468579e-19 4.550309814690719e-19 4.71748092468228e-19 4.864496652618119e-19 4.9929431533659e-19 5.10424636412988e-19 5.200216744506479e-19 5.28288905882088e-19 5.35405774490316e-19 5.41498852229418e-19 5.46645043577826e-19 5.50890811657926e-19 5.542778130622019e-19 5.56841295676602e-19 5.586213139169759e-19 5.59657922199174e-19 5.5999277711568e-19 5.59630685196396e-19 5.58453085370406e-19 5.562949534444079e-19 5.529656303989559e-19 5.48229596268852e-19 5.418080723197799e-19 5.333549883987959e-19 5.224361546380859e-19 5.08511637511992e-19 4.9089890977443e-19 4.6873279604304e-19 4.40925418383336e-19 4.06074872240568e-19 3.62378708901486e-19 3.07422448178652e-19 ] } }