{ "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" [ 4.26311 3.977465 3.800434 3.671811 3.57073 3.48745 3.41663 3.355023 3.300506 3.251613 3.207292 3.166761 3.129422 3.094808 3.06255 3.032346 3.003951 2.97716 2.951802 2.927731 2.904822 2.882969 2.862079 2.84207 2.828448 2.814112 2.798983 2.782966 2.765952 2.747809 2.728375 2.707453 2.684796 2.660089 2.632926 2.602763 2.568853 2.530134 2.485009 2.430934 2.363456 2.27366 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.26311e-10 3.977465e-10 3.800434e-10 3.671811e-10 3.57073e-10 3.48745e-10 3.41663e-10 3.3550230000000004e-10 3.300506e-10 3.251613e-10 3.207292e-10 3.1667610000000004e-10 3.129422e-10 3.094808e-10 3.06255e-10 3.032346e-10 3.003951e-10 2.97716e-10 2.9518019999999997e-10 2.927731e-10 2.904822e-10 2.882969e-10 2.862079e-10 2.84207e-10 2.828448e-10 2.8141120000000003e-10 2.798983e-10 2.782966e-10 2.7659520000000003e-10 2.7478090000000003e-10 2.7283750000000004e-10 2.707453e-10 2.684796e-10 2.660089e-10 2.632926e-10 2.602763e-10 2.568853e-10 2.530134e-10 2.485009e-10 2.4309340000000003e-10 2.363456e-10 2.27366e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.0302 1.45128 1.76961 2.02623 2.23979 2.42096 2.57793 2.71965 2.84243 2.94691 3.03738 3.11594 3.18397 3.2425 3.29243 3.3345 3.36938 3.39767 3.42005 3.43745 3.45118 3.46229 3.47015 3.47297 3.4716 3.46722 3.45951 3.4481 3.43247 3.41164 3.38383 3.34665 3.2974 3.23265 3.14748 3.03449 2.88229 2.67269 2.37476 1.93197 1.23168 -0.0139702 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.6505623547481602e-19 2.325206886234624e-19 2.835227769933888e-19 3.2463783343635843e-19 3.5885391735016324e-19 3.878805511891968e-19 4.130299176058944e-19 4.35735964675872e-19 4.554074892260544e-19 4.721470305601728e-19 4.866419224485505e-19 4.992286219815553e-19 5.101282295328576e-19 5.195057692944001e-19 5.275054371620544e-19 5.3424579420576e-19 5.398341862591104e-19 5.443667439193537e-19 5.47952415196704e-19 5.50740202516896e-19 5.529399910172544e-19 5.547200092429632e-19 5.55979320066912e-19 5.564311338739777e-19 5.56211635676928e-19 5.555098823170176e-19 5.542746041423808e-19 5.524465206180481e-19 5.499423185597376e-19 5.466049846586112e-19 5.4214933147616645e-19 5.36192438800032e-19 5.28301718942592e-19 5.179276253229121e-19 5.042818870435584e-19 4.861788934051392e-19 4.617937652365632e-19 4.282121432645952e-19 3.8047849520110086e-19 3.095357166086976e-19 1.9733689003069442e-19 -2.238272782790016e-21 ] } }