{ "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" [ "Ni" "Ni" "Ni" "Ni" ] } "a" { "source-value" [ 5.27718 4.923589 4.704448 4.54523 4.420104 4.317015 4.22935 4.153088 4.085603 4.02508 3.970217 3.920044 3.873823 3.830977 3.791045 3.753657 3.718508 3.685344 3.653954 3.624157 3.595799 3.568748 3.542889 3.51812 3.501258 3.483512 3.464783 3.444957 3.423896 3.401436 3.37738 3.351481 3.323434 3.292851 3.259226 3.221888 3.179912 3.131982 3.076124 3.009186 2.925656 2.8145 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.277180000000001e-10 4.923589e-10 4.704448000000001e-10 4.54523e-10 4.4201040000000003e-10 4.317015e-10 4.2293500000000005e-10 4.1530880000000007e-10 4.0856030000000003e-10 4.02508e-10 3.970217e-10 3.920044e-10 3.8738229999999997e-10 3.830977e-10 3.791045e-10 3.753657e-10 3.718508e-10 3.685344e-10 3.6539540000000003e-10 3.624157e-10 3.5957990000000003e-10 3.568748e-10 3.5428890000000004e-10 3.51812e-10 3.501258e-10 3.483512e-10 3.4647830000000005e-10 3.444957e-10 3.423896e-10 3.401436e-10 3.37738e-10 3.3514810000000004e-10 3.323434e-10 3.2928510000000005e-10 3.259226e-10 3.221888e-10 3.1799119999999997e-10 3.131982e-10 3.0761240000000003e-10 3.009186e-10 2.925656e-10 2.8145e-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" [ 1.5658 2.07903 2.47143 2.79745 3.0526 3.24933 3.40781 3.54266 3.66235 3.7699 3.86587 3.951 4.02661 4.09349 4.15244 4.20517 4.25318 4.29577 4.32989 4.35234 4.36574 4.37566 4.38289 4.38551 4.38423 4.3801 4.37257 4.361 4.34462 4.32255 4.2937 4.25668 4.20917 4.14724 4.06384 3.94566 3.76608 3.46926 2.92388 1.76677 -1.19556 -11.0919 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.5086881528486404e-19 3.330973259941824e-19 3.959667365943744e-19 4.48200898785696e-19 4.89080435265408e-19 5.206000559264064e-19 5.459913510128448e-19 5.675967027443329e-19 5.86773154718688e-19 6.04004564275392e-19 6.193806533052097e-19 6.330199828780801e-19 6.451340403079488e-19 6.558493975478593e-19 6.652942287274753e-19 6.737425060489536e-19 6.814345560054145e-19 6.882582262334016e-19 6.937248528635712e-19 6.973217393772672e-19 6.994686560491392e-19 7.010580152569728e-19 7.022163889538112e-19 7.026361592284608e-19 7.024310806209984e-19 7.01769381676608e-19 7.005629426811455e-19 6.9870922433088e-19 6.960848590260096e-19 6.92548855223904e-19 6.87926575672896e-19 6.819953178226945e-19 6.743833766972737e-19 6.644610968846593e-19 6.510989438671873e-19 6.321644205625728e-19 6.033925328062465e-19 5.558367263476608e-19 4.684572178024705e-19 2.830677588330816e-19 -1.915498280763648e-19 -1.7771182860251524e-18 ] } }