{ "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" [ 5.27771 4.924083 4.70492 4.545685 4.420547 4.317446 4.229772 4.153503 4.086011 4.025482 3.970613 3.920435 3.87421 3.831359 3.791423 3.754031 3.718878 3.685711 3.654318 3.624518 3.596157 3.569103 3.543241 3.51847 3.501607 3.483858 3.465128 3.445299 3.424236 3.401775 3.377716 3.351814 3.323765 3.293179 3.259551 3.222208 3.180229 3.132294 3.07643 3.009485 2.925947 2.81478 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.27771e-10 4.924083e-10 4.70492e-10 4.545685e-10 4.4205470000000004e-10 4.3174460000000007e-10 4.2297719999999996e-10 4.153503e-10 4.086011e-10 4.025482e-10 3.970613e-10 3.920435e-10 3.8742100000000005e-10 3.831359e-10 3.791423e-10 3.754031e-10 3.718878e-10 3.685711e-10 3.654318e-10 3.6245180000000003e-10 3.596157e-10 3.569103e-10 3.5432410000000004e-10 3.5184700000000006e-10 3.501607e-10 3.4838580000000003e-10 3.465128e-10 3.445299e-10 3.424236e-10 3.4017750000000004e-10 3.377716e-10 3.351814e-10 3.323765e-10 3.293179e-10 3.259551e-10 3.2222080000000005e-10 3.1802290000000005e-10 3.132294e-10 3.07643e-10 3.009485e-10 2.925947e-10 2.81478e-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" [ 2.44495 2.74934 2.95538 3.13205 3.27071 3.37244 3.4506 3.51797 3.58365 3.65108 3.72054 3.79223 3.86696 3.94338 4.01633 4.07773 4.12329 4.15783 4.19398 4.24357 4.29606 4.32971 4.3428 4.34572 4.34448 4.34033 4.33257 4.32029 4.30238 4.27747 4.24378 4.19904 4.14025 4.06333 3.96242 3.82855 3.64707 3.39421 3.02827 2.45103 1.37454 -1.31724 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.91724172902496e-19 4.4049282706302725e-19 4.735040741579904e-19 5.01809728517664e-19 5.240255095416768e-19 5.403244523050752e-19 5.52847064773248e-19 5.636409286675776e-19 5.74164024712992e-19 5.849675016670464e-19 5.960962204751233e-19 6.075822246696384e-19 6.195552905568768e-19 6.317991242930304e-19 6.434870027417665e-19 6.533243671934784e-19 6.606238838778432e-19 6.661578019260864e-19 6.719496704102784e-19 6.798948642728256e-19 6.883046893554048e-19 6.936960136843969e-19 6.957932628810241e-19 6.962610984542976e-19 6.960624285533184e-19 6.953975252556864e-19 6.941542361979456e-19 6.921867633076032e-19 6.893172649797505e-19 6.853262430173376e-19 6.799285099818624e-19 6.7276037178040325e-19 6.6334117542672e-19 6.510172328595263e-19 6.348496685790336e-19 6.13401330156384e-19 5.843250288421056e-19 5.438123908085568e-19 4.851823395470016e-19 3.926982962879424e-19 2.202255852354432e-19 -2.110451131982592e-19 ] } }