{ "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 2.853418 2.838955 2.823692 2.807534 2.79037 2.772066 2.752461 2.731354 2.708497 2.683572 2.656169 2.625739 2.59153 2.552469 2.506946 ] "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 2.853418e-10 2.838955e-10 2.823692e-10 2.807534e-10 2.79037e-10 2.772066e-10 2.752461e-10 2.7313540000000003e-10 2.708497e-10 2.683572e-10 2.656169e-10 2.625739e-10 2.59153e-10 2.552469e-10 2.506946e-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 3.49419 3.49084 3.48459 3.47472 3.46031 3.44016 3.41264 3.3756 3.32601 3.25959 3.17002 3.04776 2.87777 2.63518 2.27604 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4586808761112898e-19 2.2406279824225923e-19 2.811531577712256e-19 3.2494865570079357e-19 3.5987770821085437e-19 3.8913185113004166e-19 4.1424276530784005e-19 4.360115390546496e-19 4.550309777201664e-19 4.717480885815936e-19 4.864496612540545e-19 4.992943112230081e-19 5.104246322077057e-19 5.200216701662976e-19 5.282889015296256e-19 5.354057700792193e-19 5.414988477681217e-19 5.466450390741313e-19 5.508908071192513e-19 5.542778084956224e-19 5.568412910889024e-19 5.586213093146112e-19 5.596579175882689e-19 5.599927725020161e-19 5.598309526633152e-19 5.592942234953472e-19 5.582928631073472e-19 5.567115147826177e-19 5.544027782720448e-19 5.511743923811328e-19 5.467652023206912e-19 5.40830740117248e-19 5.328855462547009e-19 5.222438891393472e-19 5.078931931468417e-19 4.883049817809408e-19 4.610695814039616e-19 4.2220237875997445e-19 3.6466180760056324e-19 ] } }