{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "I" ] } "a" { "source-value" [ 7.7379 7.219432 6.898106 6.664646 6.481175 6.330015 6.201472 6.089651 5.990697 5.901953 5.821507 5.747939 5.680166 5.61734 5.558789 5.503967 5.452427 5.4038 5.357772 5.314081 5.272501 5.232836 5.194918 5.1586 5.121884 5.084048 5.045022 5.004727 4.96308 4.919986 4.87534 4.829027 4.780917 4.730866 4.678711 4.624265 4.567319 4.507633 4.444929 4.378886 4.309127 4.23521 4.156608 4.072685 3.98267 3.885607 3.7803 3.665215 3.53835 3.397016 3.237481 3.054356 2.839433 2.5793 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.7379e-10 7.219432000000001e-10 6.898106e-10 6.664646e-10 6.481175000000001e-10 6.330015e-10 6.201472e-10 6.089651e-10 5.990697e-10 5.901953e-10 5.821507e-10 5.747939e-10 5.680166e-10 5.61734e-10 5.558789e-10 5.503967000000001e-10 5.452427e-10 5.4038e-10 5.357772e-10 5.314081e-10 5.272501e-10 5.232836e-10 5.194918000000001e-10 5.1586e-10 5.121884e-10 5.084048e-10 5.045022e-10 5.004727e-10 4.96308e-10 4.919986e-10 4.87534e-10 4.829027e-10 4.780917e-10 4.730866e-10 4.678711e-10 4.6242650000000005e-10 4.5673190000000007e-10 4.507633e-10 4.4449290000000003e-10 4.378886e-10 4.3091270000000005e-10 4.2352100000000006e-10 4.1566080000000004e-10 4.072685e-10 3.9826700000000004e-10 3.885607e-10 3.7803000000000004e-10 3.665215e-10 3.53835e-10 3.397016e-10 3.237481e-10 3.054356e-10 2.839433e-10 2.5793e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0.00122298 0.01456 0.0442937 0.0878574 0.139297 0.193034 0.245176 0.29349 0.336949 0.375285 0.408652 0.437406 0.461979 0.482803 0.500279 0.514763 0.526556 0.535917 0.543062 0.548171 0.551395 0.552858 0.553195 0.552511 0.550359 0.546581 0.541012 0.533479 0.523802 0.511786 0.497212 0.4798 0.459153 0.43466 0.405322 0.369501 0.324528 0.266153 0.187797 0.0795582 -0.0730646 -0.288761 -0.595713 -1.03189 -1.65032 -2.5295 -3.79617 -5.66827 -8.54763 -13.188 -21.056 -35.3506 -64.616 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 1.95942997984932e-22 2.3327691791039997e-21 7.09663311734058e-21 1.407630734039916e-20 2.23178398586298e-20 3.09274564367556e-20 3.92815258417584e-20 4.7022282031265994e-20 5.3985181464966595e-20 6.012728580906899e-20 6.54732685837368e-20 7.00801672771404e-20 7.40171959198686e-20 7.735356854251019e-20 8.01535324280886e-20 8.247412506477419e-20 8.43635719692504e-20 8.58633695163378e-20 8.70081247213308e-20 8.782667676364139e-20 8.834321851044298e-20 8.857761695199719e-20 8.8631610304563e-20 8.85220214227974e-20 8.81772330111606e-20 8.757193067883539e-20 8.66796785113608e-20 8.54727588529686e-20 8.392233252424679e-20 8.199715708083239e-20 7.966214485444079e-20 7.687243489931999e-20 7.356442080310019e-20 6.964020957344399e-20 6.49397437646148e-20 5.92005868439634e-20 5.1995117867875197e-20 4.264241176690019e-20 3.00883965335298e-20 1.2746628908309879e-20 -1.1706239489255639e-20 -4.6264612701047395e-20 -9.54437449170042e-20 -1.6532700468582599e-19 -2.64410414262288e-19 -4.052705795703e-19 -6.082134872691779e-19 -9.08156974920318e-19 -1.369481306207742e-18 -2.1129505449192e-18 -3.3735431205503998e-18 -5.66379053178804e-18 -1.03526245382544e-17 ] } }