{ "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" [ "Au" "Au" ] } "a" { "source-value" [ 4.84905 4.524146 4.322783 4.176482 4.061508 3.966782 3.886229 3.816154 3.754144 3.698531 3.648119 3.602017 3.559546 3.520175 3.483483 3.449128 3.416831 3.386357 3.357514 3.330134 3.304077 3.279221 3.255459 3.2327 3.209692 3.185981 3.161525 3.136274 3.110175 3.083169 3.055191 3.026169 2.996021 2.964655 2.931971 2.897852 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.84905e-10 4.524146e-10 4.3227830000000006e-10 4.176482e-10 4.061508e-10 3.966782e-10 3.8862290000000004e-10 3.816154e-10 3.754144e-10 3.6985310000000003e-10 3.648119e-10 3.6020170000000003e-10 3.559546e-10 3.520175e-10 3.483483e-10 3.449128e-10 3.416831e-10 3.386357e-10 3.3575140000000004e-10 3.330134e-10 3.304077e-10 3.2792210000000004e-10 3.255459e-10 3.2327e-10 3.2096920000000003e-10 3.1859810000000003e-10 3.161525e-10 3.136274e-10 3.110175e-10 3.0831689999999997e-10 3.055191e-10 3.026169e-10 2.996021e-10 2.964655e-10 2.931971e-10 2.897852e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.761532 1.15524 1.48211 1.7649 2.01441 2.237 2.43683 2.61685 2.77927 2.92579 3.05777 3.17633 3.28239 3.37673 3.46004 3.53289 3.5958 3.64923 3.69356 3.72918 3.7564 3.77552 3.78681 3.79052 3.78647 3.77326 3.74903 3.71156 3.65812 3.58542 3.48938 3.36501 3.20609 3.00484 2.75152 2.43372 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.220108776443288e-19 1.85089853466216e-19 2.37460201101774e-19 2.8276815413466e-19 3.2274406332959393e-19 3.584069130258e-19 3.90423208703022e-19 4.1926559246828996e-19 4.452881453577179e-19 4.68763237399086e-19 4.89908764614618e-19 5.08904170787322e-19 5.258968561675259e-19 5.410117905326819e-19 5.54359524070536e-19 5.6603138084922595e-19 5.7611067405372e-19 5.84671103809182e-19 5.91773552827704e-19 5.974805059980119e-19 6.0184163079576e-19 6.0490499251996795e-19 6.06713849939754e-19 6.073082574709679e-19 6.066593759341979e-19 6.04542900600684e-19 6.00660826616502e-19 5.946574707689039e-19 5.860954388368079e-19 5.74447614707628e-19 5.59060310314692e-19 5.39134039517634e-19 5.13672248450106e-19 4.8142844369085595e-19 4.40842105198368e-19 3.89924931769848e-19 ] } }