{ "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" [ "Na" "Na" "Na" "Na" ] } "a" { "source-value" [ 6.84879 6.389896 6.105491 5.898857 5.736467 5.602676 5.488903 5.38993 5.302346 5.223799 5.152597 5.087482 5.027496 4.971889 4.920066 4.871543 4.825926 4.782886 4.742147 4.703476 4.666673 4.631566 4.598005 4.56586 4.543977 4.520945 4.496639 4.470907 4.443574 4.414426 4.383205 4.349593 4.313193 4.273502 4.229863 4.181405 4.126928 4.064724 3.99223 3.905357 3.79695 3.65269 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.84879e-10 6.389896000000001e-10 6.105491e-10 5.898857e-10 5.736467000000001e-10 5.602676e-10 5.488902999999999e-10 5.389929999999999e-10 5.302346000000001e-10 5.223799e-10 5.152597e-10 5.087482e-10 5.027496e-10 4.971889e-10 4.920066000000001e-10 4.871543e-10 4.825926e-10 4.782886000000001e-10 4.742147e-10 4.703476e-10 4.666673000000001e-10 4.6315660000000003e-10 4.598005e-10 4.56586e-10 4.543977e-10 4.520945e-10 4.4966390000000003e-10 4.4709070000000007e-10 4.443574e-10 4.414426e-10 4.3832050000000005e-10 4.349593e-10 4.313193e-10 4.273502e-10 4.229863e-10 4.181405e-10 4.1269280000000006e-10 4.0647240000000003e-10 3.99223e-10 3.905357e-10 3.79695e-10 3.65269e-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" [ 0.995921 1.4881 1.92364 2.32222 2.69253 3.03896 3.3655 3.6728 3.96148 4.2328 4.4865 4.72261 4.94131 5.14275 5.32635 5.49188 5.63911 5.76814 5.8782 5.96893 6.03995 6.09116 6.12272 6.13333 6.12799 6.11 6.07575 6.02048 5.93778 5.81894 5.6519 5.41962 5.09763 4.65 4.01988 3.11777 1.79404 -0.217956 -3.42838 -8.92893 -19.4178 -43.3029 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5956413423637568e-19 2.38419902941248e-19 3.0820110348357124e-19 3.7206065923541764e-19 4.3139086168026244e-19 4.868950663546368e-19 5.3921254173024e-19 5.88447429287424e-19 6.346990639766784e-19 6.78169320052224e-19 7.188165409219201e-19 7.566455331156289e-19 7.916851358125248e-19 8.239593816619201e-19 8.53375344419808e-19 8.798961740239104e-19 9.034850204119487e-19 9.241579053501312e-19 9.41791461238656e-19 9.563280097191745e-19 9.67706668080096e-19 9.75911414555213e-19 9.809678839704577e-19 9.826677933651264e-19 9.818122310496192e-19 9.789299153088002e-19 9.7344246038256e-19 9.645872301993984e-19 9.513372295453825e-19 9.32296962583795e-19 9.05534204309952e-19 8.683188457620096e-19 8.1673036074887035e-19 7.450121286720001e-19 6.440557754421504e-19 4.995218203031617e-19 2.8743689447800325e-19 -3.492040075630848e-20 -5.492870283218304e-19 -1.4305722894759744e-18 -3.1110745187370243e-18 -6.9378893992840324e-18 ] } }