{ "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" [ 5.28208 4.928162 4.708817 4.549452 4.42421 4.321025 4.233279 4.156947 4.089399 4.02882 3.973906 3.923687 3.877423 3.834537 3.794568 3.757145 3.721963 3.688769 3.65735 3.627525 3.599141 3.572065 3.546182 3.52139 3.504512 3.486749 3.468003 3.448158 3.427077 3.404597 3.380518 3.354595 3.326522 3.29591 3.262254 3.22488 3.182865 3.13489 3.078979 3.011978 2.92837 2.81711 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.28208e-10 4.928162000000001e-10 4.708817e-10 4.549452e-10 4.4242100000000007e-10 4.321025e-10 4.233279e-10 4.156947e-10 4.0893990000000006e-10 4.02882e-10 3.973906e-10 3.923687e-10 3.877423e-10 3.8345370000000005e-10 3.794568e-10 3.7571450000000003e-10 3.7219630000000003e-10 3.688769e-10 3.6573500000000003e-10 3.627525e-10 3.599141e-10 3.5720649999999997e-10 3.546182e-10 3.52139e-10 3.5045120000000004e-10 3.486749e-10 3.468003e-10 3.448158e-10 3.4270770000000004e-10 3.404597e-10 3.380518e-10 3.3545950000000004e-10 3.326522e-10 3.29591e-10 3.262254e-10 3.22488e-10 3.182865e-10 3.13489e-10 3.078979e-10 3.0119780000000003e-10 2.92837e-10 2.81711e-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" [ 1.52821 2.01413 2.37697 2.67066 2.91768 3.13003 3.31501 3.4775 3.62095 3.74791 3.86035 3.95983 4.04759 4.12467 4.19193 4.25012 4.29985 4.34168 4.37608 4.40348 4.42426 4.43874 4.44723 4.45 4.44865 4.44422 4.43597 4.42301 4.40415 4.37788 4.34217 4.29429 4.2305 4.14554 4.03183 3.87802 3.66656 3.36881 2.93501 2.27121 1.17759 -0.853979 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.4484623336727683e-19 3.2269919972519044e-19 3.808325762342976e-19 4.278869014105728e-19 4.674638682975744e-19 5.014860888402624e-19 5.311231519718208e-19 5.571569198832e-19 5.8014014350857605e-19 6.004813778862529e-19 6.184962518105281e-19 6.344347048342465e-19 6.484954068583871e-19 6.608449842515137e-19 6.716212242030144e-19 6.809442899594496e-19 6.889119142946881e-19 6.956138190994945e-19 7.011253066750464e-19 7.055152706160384e-19 7.088445936340609e-19 7.111645453809793e-19 7.125247933320384e-19 7.129685962560001e-19 7.12752302412192e-19 7.120425381691776e-19 7.107207424570176e-19 7.086443215564608e-19 7.056226164496319e-19 7.014136984667905e-19 6.956923257539137e-19 6.880211040935233e-19 6.7780081942944e-19 6.641887268591232e-19 6.459703765040064e-19 6.213272978994816e-19 5.874476710760449e-19 5.397428621917248e-19 4.702404403814209e-19 3.6388795629271683e-19 1.886707166887872e-19 -1.3682251884541634e-19 ] } }