{ "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" [ 4.35482 4.06303 3.882191 3.750801 3.647545 3.562473 3.49013 3.427198 3.371508 3.321563 3.276289 3.234886 3.196743 3.161385 3.128433 3.09758 3.068574 3.041207 3.015303 2.990714 2.967312 2.944989 2.923649 2.90321 2.889295 2.874651 2.859195 2.842834 2.825454 2.806921 2.787069 2.765696 2.742552 2.717314 2.689566 2.658754 2.624115 2.584562 2.538467 2.483228 2.414298 2.32257 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.3548200000000005e-10 4.0630300000000006e-10 3.8821910000000005e-10 3.7508010000000004e-10 3.647545e-10 3.562473e-10 3.4901300000000004e-10 3.427198e-10 3.371508e-10 3.321563e-10 3.276289e-10 3.234886e-10 3.196743e-10 3.1613850000000005e-10 3.128433e-10 3.09758e-10 3.068574e-10 3.041207e-10 3.015303e-10 2.990714e-10 2.9673120000000004e-10 2.9449890000000003e-10 2.923649e-10 2.90321e-10 2.8892950000000005e-10 2.8746510000000003e-10 2.8591950000000003e-10 2.8428339999999997e-10 2.825454e-10 2.806921e-10 2.787069e-10 2.7656960000000004e-10 2.742552e-10 2.7173140000000003e-10 2.689566e-10 2.658754e-10 2.6241150000000004e-10 2.5845620000000003e-10 2.538467e-10 2.483228e-10 2.414298e-10 2.3225699999999998e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.123183 0.963553 1.47697 1.79642 2.03388 2.20745 2.3477 2.47583 2.60146 2.72625 2.8478 2.96245 3.06687 3.15878 3.2371 3.30183 3.35381 3.39435 3.42505 3.44749 3.46316 3.4733 3.47889 3.48064 3.47982 3.47714 3.47218 3.46432 3.45268 3.43601 3.41252 3.37969 3.33403 3.27182 3.19117 3.09432 2.99167 2.90679 2.88463 3.02299 3.63528 6.16872 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.9736092268000642e-20 1.5437820895017024e-19 2.366366803622976e-19 2.878182125137536e-19 3.258634985512704e-19 3.5367247815849605e-19 3.7614300526521606e-19 3.9667169430752644e-19 4.167998391946368e-19 4.367934012456e-19 4.56267858071424e-19 4.74636813028896e-19 4.913667413032896e-19 5.060923466250625e-19 5.1864059391916805e-19 5.290114831856064e-19 5.373395972605248e-19 5.43834821281248e-19 5.487535035071041e-19 5.523487878441793e-19 5.548593986089728e-19 5.56484005702464e-19 5.573796224334912e-19 5.576600033421312e-19 5.575286248592257e-19 5.570992415248512e-19 5.563045619209344e-19 5.550452510969856e-19 5.531803175103744e-19 5.505094890835009e-19 5.467459762012416e-19 5.414860303551553e-19 5.341704919045824e-19 5.242033511465856e-19 5.112817966998336e-19 4.957647161273856e-19 4.793183731148737e-19 4.657190979575232e-19 4.621686745658304e-19 4.843363902912193e-19 5.824360626061824e-19 9.883378964261378e-19 ] } }