{ "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" [ 1.77133444301772e-19 2.44440884696112e-19 2.94657906935574e-19 3.3487894915551e-19 3.6826190150153393e-19 3.9655634085797396e-19 4.2086136039575397e-19 4.419187678964159e-19 4.602636903557159e-19 4.7629506975552e-19 4.90318921832922e-19 5.02581981789558e-19 5.13279715174776e-19 5.225739418286099e-19 5.306008467649499e-19 5.3747578670144395e-19 5.432948922361319e-19 5.4814468090725e-19 5.5209725066332795e-19 5.552182907463599e-19 5.575654795151699e-19 5.59188484445412e-19 5.601321664828379e-19 5.60438182219932e-19 5.602907819696039e-19 5.59806924626136e-19 5.589129100643639e-19 5.5751741421615e-19 5.555002738339439e-19 5.52707679960882e-19 5.48940962694348e-19 5.4393255853646395e-19 5.37318773391312e-19 5.28594921619182e-19 5.170464324413099e-19 5.01615869279256e-19 4.80694646792484e-19 4.51700056246986e-19 4.1024053148896794e-19 3.48215467456926e-19 2.4883405302654e-19 6.90152004685206e-20 ] } }