{ "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" [ 4.19154 3.910691 3.736633 3.61017 3.510785 3.428903 3.359273 3.298701 3.245098 3.197026 3.15345 3.113599 3.076887 3.042855 3.011138 2.981442 2.953523 2.927182 2.90225 2.878583 2.856059 2.834573 2.814033 2.79436 2.780967 2.766872 2.751996 2.736248 2.71952 2.701681 2.682573 2.662002 2.639725 2.615434 2.588726 2.559069 2.525729 2.487659 2.443292 2.390125 2.323779 2.23549 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.19154e-10 3.910691e-10 3.736633e-10 3.6101700000000004e-10 3.510785e-10 3.4289030000000004e-10 3.359273e-10 3.298701e-10 3.2450980000000004e-10 3.1970260000000005e-10 3.15345e-10 3.1135989999999997e-10 3.0768870000000005e-10 3.042855e-10 3.011138e-10 2.981442e-10 2.9535230000000003e-10 2.9271820000000004e-10 2.90225e-10 2.878583e-10 2.8560590000000005e-10 2.834573e-10 2.814033e-10 2.7943600000000004e-10 2.780967e-10 2.7668720000000004e-10 2.751996e-10 2.736248e-10 2.7195200000000004e-10 2.701681e-10 2.6825730000000003e-10 2.6620020000000003e-10 2.639725e-10 2.615434e-10 2.588726e-10 2.559069e-10 2.5257290000000003e-10 2.487659e-10 2.4432920000000003e-10 2.390125e-10 2.323779e-10 2.23549e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.48091 1.95844 2.31558 2.60489 2.84837 3.05775 3.24021 3.40053 3.5421 3.66744 3.77848 3.87674 3.96345 4.03963 4.10613 4.16367 4.21287 4.25426 4.28831 4.31543 4.336 4.35035 4.35876 4.36151 4.36018 4.35578 4.3476 4.33475 4.31604 4.28997 4.25452 4.20698 4.14361 4.05918 3.9461 3.79309 3.58258 3.28593 2.85332 2.19055 1.09689 -0.939356 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.3726793990569396e-19 3.13776680709096e-19 3.70996817015772e-19 4.17349389214026e-19 4.563591858986579e-19 4.899055602613499e-19 5.191388751253139e-19 5.448249709216019e-19 5.6750698552914e-19 5.87588667459696e-19 6.05379236803632e-19 6.21122224409316e-19 6.3501469800272995e-19 6.472200796005419e-19 6.57874554216642e-19 6.670934785686779e-19 6.749761876079579e-19 6.816075966960841e-19 6.87063008134854e-19 6.91408111166262e-19 6.947037885024e-19 6.970029119721899e-19 6.98350342521384e-19 6.987909410957339e-19 6.985778516034119e-19 6.97872893884452e-19 6.9656231339784e-19 6.945035164231499e-19 6.9150584394093595e-19 6.87328969456098e-19 6.81649253288568e-19 6.740325055705319e-19 6.63879512240874e-19 6.503523349200119e-19 6.3223492154274e-19 6.07720016865906e-19 5.73992596543572e-19 5.26464026695962e-19 4.57152263332488e-19 3.5096480256087e-19 1.7574115280682598e-19 -1.5050142342077038e-19 ] } }