{ "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" [ 6.31608 5.892879 5.630596 5.440034 5.290275 5.16689 5.061967 4.970693 4.889921 4.817484 4.751819 4.69177 4.636449 4.585168 4.537375 4.492626 4.450557 4.410865 4.373295 4.337632 4.303692 4.271315 4.240365 4.21072 4.190539 4.169299 4.146883 4.123153 4.097946 4.071065 4.042273 4.011275 3.977707 3.941103 3.900859 3.856169 3.80593 3.748564 3.681709 3.601593 3.501619 3.36858 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.31608e-10 5.892879e-10 5.630596e-10 5.440034e-10 5.290275e-10 5.166890000000001e-10 5.061967000000001e-10 4.970693e-10 4.889921e-10 4.817484e-10 4.751819e-10 4.69177e-10 4.6364489999999997e-10 4.5851680000000005e-10 4.537375e-10 4.4926259999999996e-10 4.450557e-10 4.4108650000000005e-10 4.3732949999999997e-10 4.3376320000000005e-10 4.303692e-10 4.2713150000000007e-10 4.240365e-10 4.2107200000000004e-10 4.190539e-10 4.169299e-10 4.146883e-10 4.1231530000000003e-10 4.0979460000000006e-10 4.071065e-10 4.042273e-10 4.0112750000000007e-10 3.9777070000000003e-10 3.9411030000000004e-10 3.9008590000000003e-10 3.856169e-10 3.80593e-10 3.7485640000000003e-10 3.681709e-10 3.601593e-10 3.501619e-10 3.3685800000000005e-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" [ 2.76504 2.98283 3.08223 3.13946 3.17956 3.21342 3.24663 3.28182 3.31942 3.35848 3.39753 3.43508 3.46998 3.50146 3.52915 3.55297 3.57302 3.58955 3.60284 3.6132 3.6209 3.62618 3.62924 3.63023 3.62975 3.62818 3.62525 3.62064 3.61393 3.60454 3.59172 3.57447 3.55139 3.52055 3.47912 3.42287 3.34495 3.23363 3.0669 2.7997 2.32838 1.37317 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 4.430082443576832e-19 4.779020489820864e-19 4.938276845928384e-19 5.029969413936768e-19 5.094216696430848e-19 5.148466396811137e-19 5.201674682387905e-19 5.258055277673856e-19 5.318297118615936e-19 5.380878137424384e-19 5.443443134466625e-19 5.503604866577664e-19 5.559520830643585e-19 5.609957350666368e-19 5.65432162129632e-19 5.692485468403776e-19 5.724609109650816e-19 5.751093089192641e-19 5.7723860164830725e-19 5.78898456627456e-19 5.80132132625472e-19 5.809780818812545e-19 5.814683479272192e-19 5.816269634126785e-19 5.8155005893488e-19 5.812985172054145e-19 5.8082907945552e-19 5.800904760333312e-19 5.790154155207744e-19 5.775109716738432e-19 5.754569812459777e-19 5.726932265750976e-19 5.689954029342913e-19 5.64054290235744e-19 5.574164724957697e-19 5.484042290037697e-19 5.35920068774496e-19 5.180846386317504e-19 4.91371547833152e-19 4.485613885253761e-19 3.7304760003383046e-19 2.200060870383936e-19 ] } }