{ "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" [ "Fe" ] } "a" { "source-value" [ 3.58293 3.34286 3.194075 3.085974 3.00102 2.931028 2.871508 2.81973 2.773911 2.732819 2.69557 2.661506 2.630124 2.601033 2.573922 2.548537 2.524673 2.502156 2.480844 2.460613 2.44136 2.422994 2.405437 2.38862 2.377172 2.365123 2.352407 2.338946 2.324647 2.309398 2.293065 2.275481 2.256439 2.235674 2.212845 2.187494 2.158995 2.126453 2.088529 2.043081 1.986369 1.9109 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.5829300000000004e-10 3.34286e-10 3.194075e-10 3.0859740000000005e-10 3.00102e-10 2.931028e-10 2.871508e-10 2.81973e-10 2.773911e-10 2.732819e-10 2.69557e-10 2.6615060000000004e-10 2.630124e-10 2.6010330000000003e-10 2.573922e-10 2.548537e-10 2.5246730000000003e-10 2.502156e-10 2.480844e-10 2.4606130000000003e-10 2.44136e-10 2.422994e-10 2.405437e-10 2.38862e-10 2.3771719999999997e-10 2.365123e-10 2.352407e-10 2.338946e-10 2.3246470000000002e-10 2.309398e-10 2.293065e-10 2.2754810000000002e-10 2.2564389999999999e-10 2.235674e-10 2.2128450000000002e-10 2.187494e-10 2.1589950000000002e-10 2.126453e-10 2.088529e-10 2.043081e-10 1.9863690000000002e-10 1.9109e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.993704 1.36132 1.63238 1.89689 2.08632 2.24726 2.3859 2.50642 2.61181 2.7043 2.78562 2.85713 2.91994 2.97493 3.02327 3.06499 3.10073 3.13109 3.15645 3.17719 3.19344 3.20514 3.21221 3.21458 3.21339 3.2094 3.20183 3.18966 3.17154 3.14565 3.1095 3.05964 2.99114 2.89683 2.76597 2.58183 2.31734 1.92616 1.32468 0.349084 -1.36676 -4.8136 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5920893167954433e-19 2.1810750774274563e-19 2.615361072261504e-19 3.039152810229312e-19 3.3426531275074564e-19 3.6005074328590077e-19 3.82263319956672e-19 4.015727525905536e-19 4.1845809199716486e-19 4.33276623562944e-19 4.463055238432897e-19 4.577626888586304e-19 4.678259602138752e-19 4.766363294516544e-19 4.843812512366017e-19 4.910655320985792e-19 4.967917113413184e-19 5.016559195620673e-19 5.05719039472416e-19 5.090419537839552e-19 5.116454907927552e-19 5.135200374390912e-19 5.146527763099968e-19 5.150324921691265e-19 5.148418331512512e-19 5.14202564679552e-19 5.129897169776065e-19 5.1103986803009285e-19 5.081367239932032e-19 5.03988688721952e-19 4.981968202377601e-19 4.902083676064512e-19 4.792334577539713e-19 4.641233300432064e-19 4.431572467834176e-19 4.1365476648800643e-19 3.7127879704446727e-19 3.0860485199201285e-19 2.1223713260413444e-19 5.592942234953473e-20 -2.1897909182446083e-19 -7.712237381882881e-19 ] } }