{ "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" [ 5.28601 4.931828 4.712321 4.552837 4.427502 4.32424 4.236428 4.16004 4.092441 4.031817 3.976862 3.926606 3.880308 3.83739 3.797391 3.759941 3.724733 3.691514 3.660071 3.630224 3.601819 3.574723 3.54882 3.52401 3.50712 3.489344 3.470584 3.450724 3.429628 3.407131 3.383034 3.357091 3.328998 3.298363 3.264682 3.227281 3.185235 3.137224 3.081273 3.014222 2.930552 2.81921 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.28601e-10 4.931828e-10 4.712321000000001e-10 4.5528370000000005e-10 4.4275019999999996e-10 4.32424e-10 4.236428e-10 4.1600400000000005e-10 4.092441e-10 4.031817e-10 3.9768620000000003e-10 3.926606e-10 3.880308e-10 3.83739e-10 3.7973910000000005e-10 3.7599410000000003e-10 3.724733e-10 3.6915140000000005e-10 3.660071e-10 3.6302240000000004e-10 3.601819e-10 3.574723e-10 3.5488200000000004e-10 3.52401e-10 3.5071200000000004e-10 3.489344e-10 3.4705840000000005e-10 3.450724e-10 3.4296280000000004e-10 3.407131e-10 3.383034e-10 3.357091e-10 3.328998e-10 3.2983630000000003e-10 3.264682e-10 3.227281e-10 3.1852350000000003e-10 3.1372239999999997e-10 3.081273e-10 3.014222e-10 2.9305520000000004e-10 2.81921e-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" [ 1.20861 1.77459 2.20139 2.55073 2.83797 3.08027 3.2882 3.46842 3.62557 3.76306 3.88347 3.98889 4.08265 4.16916 4.24675 4.31335 4.36906 4.41482 4.45165 4.48042 4.50187 4.51661 4.52514 4.52789 4.52657 4.52224 4.51426 4.50181 4.48384 4.45902 4.42567 4.38199 4.32537 4.25124 4.15258 4.01937 3.83688 3.58205 3.2158 2.66675 1.80022 0.234398 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.936406685665088e-19 2.843206609505472e-19 3.5270155912629124e-19 4.0867199719731846e-19 4.546929184531776e-19 4.935136579751616e-19 5.26827716451456e-19 5.557021435115136e-19 5.808803491073857e-19 6.029086754667648e-19 6.222004841578177e-19 6.390906300942912e-19 6.541126380909121e-19 6.679730680374528e-19 6.8040435643824e-19 6.91074852732768e-19 7.000005786872449e-19 7.073321389040256e-19 7.13232955398432e-19 7.178424175364736e-19 7.212790863880897e-19 7.236406947271488e-19 7.250073513846913e-19 7.254479499554113e-19 7.2523646264146575e-19 7.245427201646593e-19 7.232641832212609e-19 7.212694733283649e-19 7.183903619407872e-19 7.144137595679616e-19 7.090705005375937e-19 7.020721930579393e-19 6.930006690309697e-19 6.811237337409793e-19 6.653166592001665e-19 6.439740644344897e-19 6.147359432815104e-19 5.73907676453664e-19 5.152279577168641e-19 4.2726045035184e-19 2.884270396296576e-19 3.755469955622784e-20 ] } }