{ "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" [ 1.24243 1.7716 2.17709 2.50764 2.78563 3.02373 3.23005 3.41015 3.56808 3.7069 3.82893 3.93613 4.0301 4.11206 4.18312 4.24418 4.29604 4.33938 4.37482 4.40287 4.42402 4.43867 4.44722 4.45 4.44866 4.44425 4.4361 4.42335 4.40488 4.37927 4.34465 4.29852 4.23745 4.15672 4.04952 3.90584 3.71036 3.43837 3.0477 2.46008 1.51275 -0.196725 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.9905923153806198e-19 2.8384161247944e-19 3.48808272811506e-19 4.0176822144837597e-19 4.463071296969419e-19 4.84454955352482e-19 5.175110636651699e-19 5.463662648435099e-19 5.716694404242719e-19 5.9391085645746e-19 6.13462217922162e-19 6.30637551438642e-19 6.456932052683399e-19 6.588246449606038e-19 6.702097121218079e-19 6.799926026490119e-19 6.883014906729359e-19 6.95245324204692e-19 7.009234381955879e-19 7.0541754365395795e-19 7.088061472348679e-19 7.11153336003678e-19 7.125231970257479e-19 7.1296860213e-19 7.12753910461044e-19 7.1204735056545e-19 7.107415766087399e-19 7.0869880140039e-19 7.05739581157392e-19 7.01636406797718e-19 6.960896712908099e-19 6.886988304781679e-19 6.789143377743299e-19 6.65979965808048e-19 6.48804632291568e-19 6.2578455841425595e-19 5.94465209572824e-19 5.508876073046579e-19 4.882953727441799e-19 3.9414826937707196e-19 2.4236927030835e-19 -3.1518819832365e-20 ] } }