{ "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" [ "B" "B" "B" "B" ] } "a" { "source-value" [ 4.1109 3.835455 3.664744 3.540714 3.443242 3.362935 3.294645 3.235238 3.182667 3.13552 3.092781 3.053697 3.017691 2.984314 2.953208 2.924082 2.896701 2.870867 2.846414 2.823202 2.801112 2.780039 2.759895 2.7406 2.727465 2.71364 2.699051 2.683606 2.667199 2.649703 2.630963 2.610788 2.58894 2.565115 2.538922 2.509835 2.477136 2.439798 2.396285 2.34414 2.27907 2.19248 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1109e-10 3.835455e-10 3.664744e-10 3.540714e-10 3.443242e-10 3.362935e-10 3.294645e-10 3.235238e-10 3.182667e-10 3.1355200000000004e-10 3.092781e-10 3.053697e-10 3.017691e-10 2.984314e-10 2.953208e-10 2.9240819999999997e-10 2.896701e-10 2.870867e-10 2.8464140000000004e-10 2.823202e-10 2.801112e-10 2.780039e-10 2.7598950000000004e-10 2.7406000000000003e-10 2.7274650000000004e-10 2.71364e-10 2.699051e-10 2.6836060000000003e-10 2.667199e-10 2.649703e-10 2.630963e-10 2.610788e-10 2.58894e-10 2.565115e-10 2.538922e-10 2.5098349999999997e-10 2.477136e-10 2.439798e-10 2.396285e-10 2.34414e-10 2.27907e-10 2.1924800000000003e-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" [ 0 0 0 0 0 0 0 0 0 0 0.0262762 0.261841 0.696205 1.2662 1.90905 2.56939 3.20265 3.77622 4.26865 4.66807 4.97039 5.17738 5.29499 5.33196 5.31512 5.2619 5.16834 5.03085 4.84656 4.61393 4.33361 4.00961 3.65113 3.27488 2.90464 2.47674 1.92876 1.20782 0.225039 -1.18157 -3.34247 -7.0697 ] "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 4.2099113670310794e-21 4.1951553202319396e-20 1.1154433834739698e-19 2.0286760539708e-19 3.0586353031376995e-19 4.1166166216332593e-19 5.1312109968801e-19 6.050171448843479e-19 6.8391312887241e-19 7.47907267987638e-19 7.96344271986726e-19 8.29507726133892e-19 8.48350925526366e-19 8.542741725422639e-19 8.51576107090608e-19 8.4304932304446e-19 8.280593584567559e-19 8.0603103191589e-19 7.76504518727904e-19 7.392330836911619e-19 6.94320868286874e-19 6.42410345345274e-19 5.84975517369642e-19 5.24693621515392e-19 4.65374633818176e-19 3.96817495649316e-19 3.0902142045938397e-19 1.9351409820778798e-19 3.60552227538726e-20 -1.8930838454353798e-19 -5.3552273338459795e-19 -1.1326908149389799e-18 ] } }