{ "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" [ 4.21091 3.928763 3.753899 3.626852 3.527007 3.444747 3.374795 3.313942 3.260092 3.211798 3.16802 3.127985 3.091103 3.056914 3.02505 2.995217 2.967169 2.940706 2.915658 2.891882 2.869254 2.847669 2.827034 2.80727 2.793815 2.779655 2.76471 2.74889 2.732084 2.714163 2.694967 2.674301 2.651921 2.627518 2.600687 2.570893 2.537399 2.499153 2.454582 2.401169 2.334516 2.24582 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.2109100000000005e-10 3.928763e-10 3.753899e-10 3.626852e-10 3.527007e-10 3.444747e-10 3.3747950000000005e-10 3.3139420000000003e-10 3.2600920000000005e-10 3.211798e-10 3.16802e-10 3.127985e-10 3.091103e-10 3.056914e-10 3.02505e-10 2.995217e-10 2.9671690000000003e-10 2.9407060000000004e-10 2.915658e-10 2.891882e-10 2.8692540000000004e-10 2.847669e-10 2.827034e-10 2.80727e-10 2.793815e-10 2.779655e-10 2.76471e-10 2.74889e-10 2.732084e-10 2.7141630000000004e-10 2.6949670000000003e-10 2.674301e-10 2.6519210000000004e-10 2.627518e-10 2.600687e-10 2.5708929999999997e-10 2.537399e-10 2.499153e-10 2.454582e-10 2.401169e-10 2.334516e-10 2.2458200000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.17165 1.68114 2.08287 2.40537 2.67797 2.91255 3.11671 3.29569 3.45331 3.59246 3.71539 3.82392 3.91951 4.0034 4.07661 4.14002 4.1944 4.2404 4.2786 4.30951 4.33358 4.35123 4.3628 4.36665 4.36512 4.36047 4.35241 4.34034 4.3233 4.29991 4.26826 4.22574 4.16887 4.09288 3.99104 3.85349 3.665 3.40108 3.01968 2.44253 1.50595 -0.195647 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.8771902532261e-19 2.6934832264827597e-19 3.3371256456595804e-19 3.8538276101245797e-19 4.2905809605529802e-19 4.6664195553567e-19 4.99351993695414e-19 5.280277510907459e-19 5.53281259195854e-19 5.755755470579639e-19 5.95271104419726e-19 6.12659527428528e-19 6.27974733872934e-19 6.4141539365556e-19 6.531449287930739e-19 6.6330433082926795e-19 6.7201696736496e-19 6.7938697988136e-19 6.8550729462324e-19 6.904596225989341e-19 6.94316061756972e-19 6.971439035159819e-19 6.9899762188152e-19 6.996144598856099e-19 6.99369326860608e-19 6.98624314725798e-19 6.973329603587939e-19 6.95399133161556e-19 6.926690241772199e-19 6.889215330302939e-19 6.8385064398368395e-19 6.77038188935916e-19 6.679266104183579e-19 6.55751670176592e-19 6.394351033359359e-19 6.1739716373526595e-19 5.87197736361e-19 5.449130906364719e-19 4.83806073815712e-19 3.91336449384402e-19 2.4127979019722998e-19 -3.13461051912198e-20 ] } }