{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" [ 5.42244 5.059116 4.833943 4.670343 4.541772 4.435845 4.345767 4.267407 4.198063 4.135875 4.079501 4.027948 3.980454 3.936428 3.895398 3.85698 3.820864 3.786787 3.754533 3.723916 3.694777 3.666982 3.64041 3.61496 3.597634 3.579399 3.560155 3.539783 3.518142 3.495064 3.470345 3.443733 3.414915 3.38349 3.348939 3.310573 3.267442 3.218192 3.160796 3.092015 3.006186 2.89197 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.42244e-10 5.059116000000001e-10 4.833942999999999e-10 4.670343e-10 4.541772e-10 4.4358449999999997e-10 4.3457670000000005e-10 4.2674070000000003e-10 4.1980630000000003e-10 4.1358750000000005e-10 4.0795009999999995e-10 4.0279480000000004e-10 3.980454e-10 3.936428e-10 3.895398e-10 3.85698e-10 3.820864e-10 3.7867870000000003e-10 3.754533e-10 3.7239160000000004e-10 3.6947770000000004e-10 3.6669820000000003e-10 3.64041e-10 3.61496e-10 3.5976340000000006e-10 3.5793990000000003e-10 3.560155e-10 3.5397830000000003e-10 3.5181420000000004e-10 3.495064e-10 3.4703450000000003e-10 3.443733e-10 3.4149150000000004e-10 3.38349e-10 3.348939e-10 3.310573e-10 3.267442e-10 3.2181920000000004e-10 3.160796e-10 3.092015e-10 3.006186e-10 2.89197e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.905215 1.35247 1.69469 1.96483 2.19364 2.39606 2.57381 2.72751 2.85969 2.97334 3.07108 3.15507 3.22711 3.28873 3.34131 3.38604 3.42393 3.45578 3.48215 3.50337 3.51961 3.53103 3.53778 3.53999 3.53893 3.53544 3.52905 3.51922 3.50539 3.48622 3.45953 3.42312 3.37411 3.3086 3.22124 3.10441 2.94672 2.73009 2.42273 1.96191 1.21026 -0.175328 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.450314309797472e-19 2.1668958143333762e-19 2.715192697503552e-19 3.148004689846464e-19 3.514598722451712e-19 3.838911314034048e-19 4.1236982083812483e-19 4.369952754998209e-19 4.581728460735552e-19 4.763815833689472e-19 4.920412576606464e-19 5.054979390987456e-19 5.170400194749888e-19 5.269126318123584e-19 5.353368764845249e-19 5.425034125093632e-19 5.485740597255744e-19 5.536769922628224e-19 5.57901932011872e-19 5.613017508012096e-19 5.639036856333889e-19 5.657333713343424e-19 5.668148405533825e-19 5.671689215865793e-19 5.669990908647744e-19 5.664399312241153e-19 5.65416140363424e-19 5.638412007451776e-19 5.616253904786112e-19 5.585540178965376e-19 5.542778084956224e-19 5.484442834192896e-19 5.405920158007488e-19 5.30096156757888e-19 5.1609954179857925e-19 4.973813123377729e-19 4.721165892043776e-19 4.374086370679872e-19 3.8816413645107844e-19 3.1433263341137283e-19 1.939050277089408e-19 -2.809064225716224e-20 ] } }