{ "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" [ "Ni" "Ni" ] } "a" { "source-value" [ 4.19191 3.911037 3.736963 3.61049 3.511097 3.429208 3.359572 3.298994 3.245387 3.197311 3.153731 3.113876 3.077161 3.043126 3.011407 2.981708 2.953787 2.927444 2.902509 2.87884 2.856314 2.834826 2.814285 2.79461 2.781216 2.767119 2.752242 2.736493 2.719763 2.701922 2.682813 2.66224 2.639961 2.615668 2.588958 2.559298 2.525955 2.487882 2.443511 2.390339 2.323987 2.23569 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1919100000000004e-10 3.911037e-10 3.7369629999999997e-10 3.61049e-10 3.511097e-10 3.4292080000000004e-10 3.3595720000000003e-10 3.2989940000000003e-10 3.245387e-10 3.1973110000000003e-10 3.153731e-10 3.113876e-10 3.077161e-10 3.043126e-10 3.011407e-10 2.981708e-10 2.953787e-10 2.927444e-10 2.902509e-10 2.87884e-10 2.856314e-10 2.8348260000000004e-10 2.814285e-10 2.79461e-10 2.781216e-10 2.767119e-10 2.752242e-10 2.736493e-10 2.719763e-10 2.701922e-10 2.682813e-10 2.66224e-10 2.639961e-10 2.615668e-10 2.588958e-10 2.559298e-10 2.5259550000000005e-10 2.487882e-10 2.4435110000000003e-10 2.390339e-10 2.323987e-10 2.23569e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ -0.0250243 0.113248 0.268149 0.466637 0.701951 0.95716 1.21506 1.46151 1.68702 1.88663 2.05906 2.20543 2.32817 2.43027 2.51472 2.58429 2.64133 2.68783 2.72538 2.75533 2.77844 2.79487 2.8047 2.80796 2.80634 2.80093 2.79072 2.77443 2.75036 2.71631 2.66936 2.60568 2.52013 2.40581 2.25323 2.04899 1.77322 1.39447 0.845942 -0.0529804 -1.64111 -4.90942 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ -4.009334841188544e-21 1.8144329795235843e-20 4.2962205869089926e-20 7.476348918002496e-20 1.124649481147181e-19 1.533539374364928e-19 1.946740724869248e-19 2.341597153065408e-19 2.702904002822016e-19 3.022714478099904e-19 3.2989777928244483e-19 3.5334883848109437e-19 3.7301395432479365e-19 3.8937217762316167e-19 4.029025591858176e-19 4.1404890193672324e-19 4.231877173817664e-19 4.3063783866848643e-19 4.366540118795904e-19 4.414525308588864e-19 4.451551610295552e-19 4.477875372175297e-19 4.49362476835776e-19 4.498847864141568e-19 4.496252338015873e-19 4.487584562497344e-19 4.471226339198976e-19 4.445126882046145e-19 4.406562490783489e-19 4.352008376845248e-19 4.2767861844986886e-19 4.1747595772861444e-19 4.037693367376704e-19 3.854532536086848e-19 3.610072427285184e-19 3.282843874252992e-19 2.8410116275349763e-19 2.2341872324069765e-19 1.3553484949527937e-19 -8.488395824063233e-21 -2.6293480741610882e-19 -7.865757945687936e-19 ] } }