{ "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 3.493428 3.467621 3.441003 3.41352 3.385114 3.355721 3.32527 3.293682 3.260869 3.226731 3.191158 3.154023 3.115183 3.074473 3.031706 2.98666 2.939081 2.888665 2.835054 2.777814 2.716418 ] "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 3.493428e-10 3.467621e-10 3.4410029999999997e-10 3.4135200000000003e-10 3.3851140000000004e-10 3.355721e-10 3.32527e-10 3.293682e-10 3.260869e-10 3.226731e-10 3.1911580000000004e-10 3.1540230000000003e-10 3.115183e-10 3.074473e-10 3.031706e-10 2.9866600000000003e-10 2.939081e-10 2.8886650000000003e-10 2.835054e-10 2.777814e-10 2.716418e-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 4.34294 4.33381 4.31705 4.29126 4.25493 4.20636 4.14368 4.06471 3.96671 3.84607 3.69774 3.51519 3.29102 3.01381 2.66345 2.2066 1.58375 0.672602 -0.677978 -2.70471 -5.79917 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.9172417612983e-19 4.404928306921559e-19 4.73504078059092e-19 5.0180973265197e-19 5.24025513859014e-19 5.40324456756696e-19 5.5284706932804e-19 5.636409333112979e-19 5.7416402944341e-19 5.849675064864719e-19 5.96096225386236e-19 6.07582229675382e-19 6.19555295661264e-19 6.317991294982919e-19 6.43487008043322e-19 6.533243725760819e-19 6.606238893205859e-19 6.661578074144219e-19 6.719496759463319e-19 6.79894869874338e-19 6.883046950262039e-19 6.93696019399614e-19 6.9579326861352e-19 6.962611041906479e-19 6.958156990863959e-19 6.943529118195539e-19 6.916676637809699e-19 6.87535650241884e-19 6.81714942530562e-19 6.7393317061922395e-19 6.638907274773119e-19 6.512383385986139e-19 6.35537007585414e-19 6.16208348672838e-19 5.92443262660716e-19 5.631955282070459e-19 5.27279534602668e-19 4.82865596131554e-19 4.2673173558273e-19 3.5353629605843995e-19 2.5374472440975e-19 1.077627208381668e-19 -1.0862405099660518e-19 -4.3334231637461397e-19 -9.29129467059378e-19 ] } }