{ "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" [ "Co" "Co" "Co" "Co" ] } "a" { "source-value" [ 5.30485 4.949406 4.729116 4.569064 4.443282 4.339652 4.251528 4.174867 4.107027 4.046187 3.991036 3.940601 3.894138 3.851067 3.810926 3.773342 3.738008 3.704671 3.673116 3.643163 3.614656 3.587463 3.561468 3.53657 3.51962 3.50178 3.482953 3.463023 3.441852 3.419275 3.395092 3.369057 3.340863 3.31012 3.276319 3.238784 3.196589 3.148407 3.092256 3.024967 2.940999 2.82926 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.304850000000001e-10 4.949406e-10 4.729116000000001e-10 4.569064e-10 4.443282e-10 4.339652e-10 4.2515280000000004e-10 4.174867e-10 4.1070270000000007e-10 4.046187e-10 3.991036e-10 3.940601e-10 3.894138e-10 3.851067e-10 3.810926e-10 3.773342e-10 3.7380080000000004e-10 3.704671e-10 3.673116e-10 3.643163e-10 3.6146560000000004e-10 3.5874630000000004e-10 3.561468e-10 3.53657e-10 3.51962e-10 3.50178e-10 3.4829530000000003e-10 3.4630230000000004e-10 3.441852e-10 3.419275e-10 3.395092e-10 3.3690570000000005e-10 3.3408630000000004e-10 3.31012e-10 3.276319e-10 3.238784e-10 3.196589e-10 3.1484070000000004e-10 3.092256e-10 3.024967e-10 2.940999e-10 2.8292600000000004e-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" [ 1.17676 1.70148 2.08456 2.41525 2.69539 2.93657 3.14644 3.33032 3.49207 3.63465 3.76037 3.87106 3.96826 4.05322 4.127 4.19052 4.24455 4.28978 4.3268 4.35616 4.37832 4.39369 4.40267 4.40559 4.40418 4.39954 4.39095 4.37749 4.35799 4.33093 4.2943 4.24544 4.18068 4.09494 3.98095 3.82792 3.61934 3.32855 2.90989 2.27845 1.25701 -0.594302 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.885377360292608e-19 2.7260714767587845e-19 3.3398332966548486e-19 3.8696570833872e-19 4.3184908419381126e-19 4.704903799342656e-19 5.041152606749952e-19 5.335760843782656e-19 5.594912912197056e-19 5.823351254790721e-19 6.024776899557696e-19 6.202121829714048e-19 6.357853397255808e-19 6.493974322958976e-19 6.6121829140416e-19 6.713953172994817e-19 6.800518775816641e-19 6.872985224375425e-19 6.932297802877441e-19 6.979337708464128e-19 7.014841942381057e-19 7.039467397042753e-19 7.053854943097536e-19 7.058533298830273e-19 7.056274229794944e-19 7.048840130274432e-19 7.0350774331017605e-19 7.013512135785793e-19 6.982269691680193e-19 6.938914792321345e-19 6.88022706270144e-19 6.801944713009153e-19 6.698187755046144e-19 6.560817131578752e-19 6.37818501857376e-19 6.133003930292737e-19 5.798821930726272e-19 5.33292499116384e-19 4.662157727099712e-19 3.65047932166176e-19 2.0139520341118082e-19 -9.521767700946817e-20 ] } }