{ "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" [ 4.18655 3.906035 3.732183 3.60587 3.506604 3.424819 3.355272 3.294771 3.241233 3.193218 3.149693 3.10989 3.073221 3.03923 3.00755 2.977889 2.950004 2.923694 2.898791 2.875153 2.852655 2.831195 2.81068 2.79103 2.777653 2.763574 2.748716 2.732987 2.716278 2.69846 2.679375 2.658828 2.636578 2.612315 2.585639 2.556017 2.522716 2.484691 2.440377 2.387272 2.321004 2.23282 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1865500000000004e-10 3.906035e-10 3.732183e-10 3.60587e-10 3.506604e-10 3.424819e-10 3.355272e-10 3.294771e-10 3.241233e-10 3.193218e-10 3.1496930000000003e-10 3.10989e-10 3.0732210000000003e-10 3.03923e-10 3.00755e-10 2.9778889999999997e-10 2.950004e-10 2.923694e-10 2.898791e-10 2.875153e-10 2.852655e-10 2.8311950000000005e-10 2.8106800000000003e-10 2.79103e-10 2.777653e-10 2.763574e-10 2.748716e-10 2.7329870000000003e-10 2.716278e-10 2.69846e-10 2.679375e-10 2.6588280000000003e-10 2.636578e-10 2.6123150000000005e-10 2.585639e-10 2.5560170000000005e-10 2.522716e-10 2.4846910000000005e-10 2.440377e-10 2.387272e-10 2.321004e-10 2.23282e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.10558 1.52568 1.83911 2.09015 2.29851 2.47511 2.62681 2.75824 2.87274 2.9728 3.06033 3.13687 3.20364 3.26165 3.31175 3.35466 3.39098 3.42125 3.44592 3.4654 3.48005 3.49018 3.49607 3.49798 3.49706 3.49404 3.48846 3.47975 3.46716 3.44973 3.42622 3.39496 3.35368 3.29923 3.22715 3.13084 3.00026 2.81929 2.56052 2.17339 1.5531 0.430759 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.771334428424064e-19 2.444408826822144e-19 2.9465790450794884e-19 3.34878946396512e-19 3.682618984675008e-19 3.965563375908288e-19 4.2086135692836483e-19 4.4191876425553915e-19 4.602636865636992e-19 4.76295065831424e-19 4.903189177932864e-19 5.025819776488896e-19 5.132797109459713e-19 5.22573937523232e-19 5.306008423934401e-19 5.374757822732929e-19 5.432948877600384e-19 5.481446763912e-19 5.520972461147136e-19 5.55218286172032e-19 5.57565474921504e-19 5.591884798383745e-19 5.601321618680256e-19 5.604381776025984e-19 5.602907773534848e-19 5.598069200140032e-19 5.589129054595968e-19 5.575174096228801e-19 5.555002692572928e-19 5.527076754072385e-19 5.489409581717376e-19 5.439325540551168e-19 5.373187689644545e-19 5.285949172641984e-19 5.17046428181472e-19 5.016158651465472e-19 4.806946428321409e-19 4.5170005252552325e-19 4.102405281090816e-19 3.482154645880512e-19 2.48834050976448e-19 6.901519989991872e-20 ] } }