{ "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" [ "Ga" "Ga" ] } "a" { "source-value" [ 4.716 4.400011 4.204173 4.061886 3.950067 3.85794 3.779597 3.711445 3.651136 3.59705 3.54802 3.503183 3.461878 3.423587 3.387902 3.35449 3.323078 3.293441 3.265389 3.238761 3.213419 3.189244 3.166135 3.144 3.128931 3.113072 3.096335 3.078617 3.059795 3.039724 3.018225 2.995081 2.970016 2.942685 2.912636 2.879268 2.841756 2.798922 2.749004 2.689184 2.614536 2.5152 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.716e-10 4.400011e-10 4.204173e-10 4.0618860000000004e-10 3.9500670000000005e-10 3.8579400000000005e-10 3.779597e-10 3.711445e-10 3.651136e-10 3.59705e-10 3.54802e-10 3.503183e-10 3.461878e-10 3.423587e-10 3.387902e-10 3.35449e-10 3.3230780000000004e-10 3.2934410000000004e-10 3.265389e-10 3.2387609999999997e-10 3.2134190000000004e-10 3.1892440000000003e-10 3.1661350000000004e-10 3.144e-10 3.1289310000000005e-10 3.113072e-10 3.0963349999999997e-10 3.078617e-10 3.059795e-10 3.0397240000000003e-10 3.018225e-10 2.995081e-10 2.9700160000000005e-10 2.942685e-10 2.912636e-10 2.879268e-10 2.8417560000000004e-10 2.7989220000000003e-10 2.749004e-10 2.689184e-10 2.614536e-10 2.5152000000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0 0 0 0 0 0 0 0.0529964 0.326436 0.747876 1.22062 1.67017 2.05216 2.34908 2.56216 2.70305 2.78717 2.82933 2.84139 2.83902 2.83495 2.82908 2.82104 2.81033 2.79633 2.77819 2.74235 2.66914 2.53871 2.32261 1.98497 1.49148 0.83573 0.0945502 -0.570713 -1.47428 -2.97832 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.490959306656512e-21 5.2300812738746886e-20 1.1982294424574207e-19 1.9556488268808963e-19 2.675907326761536e-19 3.2879227741409283e-19 3.763641056388864e-19 4.105032850748928e-19 4.3307635148534405e-19 4.465538612195136e-19 4.533086378528065e-19 4.552408628574912e-19 4.548611469983616e-19 4.54209061113696e-19 4.532685834372864e-19 4.519804334341632e-19 4.502645022732865e-19 4.480214550041664e-19 4.451151066140352e-19 4.39372905605088e-19 4.2764337056421125e-19 4.0674618089911682e-19 3.7212314412362885e-19 3.180272526989376e-19 2.389614386390784e-19 1.338987067301184e-19 1.5148611993196416e-20 -9.143830257866305e-20 -2.3620569485130244e-19 -4.771794673261056e-19 ] } }