{ "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" [ 4.12673 3.850223 3.678855 3.554347 3.456499 3.375883 3.30733 3.247694 3.19492 3.147591 3.104688 3.065454 3.029309 2.995803 2.964577 2.935339 2.907853 2.881919 2.857372 2.834071 2.811895 2.790741 2.770519 2.75115 2.737964 2.724087 2.709441 2.693936 2.677467 2.659904 2.641091 2.620838 2.598906 2.57499 2.548695 2.519497 2.486672 2.449191 2.40551 2.353164 2.287844 2.20092 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1267300000000006e-10 3.8502230000000004e-10 3.678855e-10 3.554347e-10 3.456499e-10 3.375883e-10 3.30733e-10 3.247694e-10 3.19492e-10 3.147591e-10 3.104688e-10 3.065454e-10 3.0293090000000004e-10 2.995803e-10 2.9645769999999997e-10 2.935339e-10 2.907853e-10 2.881919e-10 2.8573719999999997e-10 2.834071e-10 2.811895e-10 2.790741e-10 2.7705190000000003e-10 2.75115e-10 2.737964e-10 2.724087e-10 2.709441e-10 2.693936e-10 2.677467e-10 2.659904e-10 2.641091e-10 2.620838e-10 2.598906e-10 2.5749900000000003e-10 2.548695e-10 2.519497e-10 2.486672e-10 2.449191e-10 2.40551e-10 2.353164e-10 2.2878440000000002e-10 2.20092e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.48887 2.00784 2.39033 2.69441 2.94544 3.15735 3.33876 3.49551 3.63175 3.75056 3.85431 3.94487 4.02377 4.09222 4.15127 4.20178 4.24449 4.28005 4.30901 4.33186 4.34902 4.36088 4.36777 4.37001 4.36893 4.3654 4.35889 4.34872 4.33403 4.31372 4.28633 4.24994 4.20191 4.13862 4.05489 3.94313 3.79173 3.58215 3.28286 2.83574 2.12091 0.842015 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.3854327250635796e-19 3.2169143328105597e-19 3.82973087354922e-19 4.3169207444159396e-19 4.719115144848959e-19 5.0586323953599e-19 5.34928325853384e-19 5.600424445913339e-19 5.8187049905295e-19 6.00905959641504e-19 6.17528542219254e-19 6.32037853816758e-19 6.446790274590179e-19 6.55645926518748e-19 6.65106779542518e-19 6.73199373720852e-19 6.800422701246659e-19 6.857396102351699e-19 6.903795137672339e-19 6.940404873759239e-19 6.96789822479868e-19 6.98690003967792e-19 6.99793903668618e-19 7.001527912346339e-19 6.99979756158162e-19 6.9941418780636e-19 6.983711708176259e-19 6.96741757180848e-19 6.94388159705502e-19 6.911341389618479e-19 6.86745777161322e-19 6.809154563901959e-19 6.73220202017094e-19 6.630800261005081e-19 6.49665001144026e-19 6.317590750824419e-19 6.075021208436819e-19 5.7392370294831e-19 5.25972158469324e-19 4.54335636809916e-19 3.3980724448169397e-19 1.34905675847751e-19 ] } }