{ "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" [ 4.35872 4.066669 3.885667 3.75416 3.650811 3.565664 3.493256 3.430267 3.374527 3.324538 3.279223 3.237783 3.199606 3.164217 3.131235 3.100354 3.071322 3.04393 3.018003 2.993392 2.96997 2.947627 2.926268 2.90581 2.891883 2.877225 2.861756 2.84538 2.827985 2.809434 2.789565 2.768173 2.745008 2.719747 2.691975 2.661135 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.3587200000000003e-10 4.0666690000000005e-10 3.885667e-10 3.7541600000000005e-10 3.6508110000000003e-10 3.5656640000000003e-10 3.493256e-10 3.4302670000000004e-10 3.3745270000000004e-10 3.324538e-10 3.279223e-10 3.237783e-10 3.1996060000000004e-10 3.164217e-10 3.1312350000000003e-10 3.100354e-10 3.071322e-10 3.04393e-10 3.018003e-10 2.9933920000000003e-10 2.9699700000000003e-10 2.9476270000000006e-10 2.926268e-10 2.90581e-10 2.891883e-10 2.8772250000000004e-10 2.8617560000000003e-10 2.84538e-10 2.827985e-10 2.809434e-10 2.789565e-10 2.768173e-10 2.745008e-10 2.719747e-10 2.691975e-10 2.661135e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 2.63568 3.94475 5.09796 6.15405 7.13584 8.05745 8.92441 9.73945 10.5051 11.2231 11.895 12.5203 13.099 13.6324 14.1204 14.5621 14.9553 15.2991 15.5927 15.835 16.0254 16.1634 16.247 16.2751 16.261 16.2133 16.123 15.9774 15.7596 15.4468 15.0065 14.3936 13.543 12.3577 10.6896 8.30098 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 4.2228248759101437e-19 6.3201862249008e-19 8.167832325773568e-19 9.85987503323424e-19 1.1432876017769472e-18 1.290945801326496e-18 1.4298481056433728e-18 1.5604319089450561e-18 1.6831025619166082e-18 1.7981388432900482e-18 1.9057890904416e-18 2.005973194540224e-18 2.09869115558592e-18 2.184151256539392e-18 2.262337475634432e-18 2.333105616975168e-18 2.396103201705024e-18 2.451186033928128e-18 2.498225939514816e-18 2.5370466790368004e-18 2.5675521218968325e-18 2.589662159263872e-18 2.6030563558137603e-18 2.607558472118208e-18 2.60529940308288e-18 2.5976570206016644e-18 2.5831893657158404e-18 2.559861674116992e-18 2.5249662673159683e-18 2.474850182617344e-18 2.40430634600352e-18 2.3061089409146882e-18 2.16982779754944e-18 1.979921802686016e-18 1.7126627205703682e-18 1.3299636085728384e-18 ] } }