{ "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" [ "C" "C" "C" "C" ] } "a" { "source-value" [ 4.58511 4.277891 4.087488 3.949151 3.840435 3.750865 3.674696 3.608436 3.549801 3.497215 3.449547 3.405954 3.365795 3.328568 3.293873 3.261388 3.230848 3.202034 3.17476 3.148871 3.124232 3.100729 3.07826 3.05674 3.034984 3.012564 2.989439 2.965562 2.940884 2.915348 2.888894 2.861451 2.832943 2.803285 2.77238 2.740119 2.706375 2.671008 2.633853 2.594719 2.553383 2.509583 2.463007 2.413279 2.35994 2.302425 2.240025 2.171831 2.096657 2.012909 1.918377 1.809866 1.682513 1.52837 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.5851100000000006e-10 4.2778910000000005e-10 4.087488e-10 3.949151e-10 3.840435e-10 3.750865e-10 3.674696e-10 3.6084360000000003e-10 3.5498010000000003e-10 3.497215e-10 3.449547e-10 3.405954e-10 3.365795e-10 3.3285680000000004e-10 3.293873e-10 3.2613880000000005e-10 3.230848e-10 3.202034e-10 3.17476e-10 3.1488710000000004e-10 3.1242320000000003e-10 3.100729e-10 3.0782600000000003e-10 3.05674e-10 3.0349840000000004e-10 3.012564e-10 2.989439e-10 2.965562e-10 2.940884e-10 2.915348e-10 2.8888940000000004e-10 2.8614510000000003e-10 2.8329430000000004e-10 2.803285e-10 2.77238e-10 2.740119e-10 2.706375e-10 2.6710080000000004e-10 2.633853e-10 2.594719e-10 2.5533830000000005e-10 2.509583e-10 2.4630070000000003e-10 2.4132790000000004e-10 2.35994e-10 2.302425e-10 2.2400250000000002e-10 2.1718310000000003e-10 2.096657e-10 2.012909e-10 1.918377e-10 1.8098660000000001e-10 1.682513e-10 1.52837e-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" [ 0.98165 1.49888 1.92167 2.28181 2.59502 2.87071 3.11514 3.33279 3.527 3.7004 3.85506 3.9927 4.11473 4.22237 4.31663 4.39842 4.46851 4.5276 4.57629 4.61514 4.64463 4.66521 4.6773 4.68125 4.67698 4.66311 4.63786 4.59906 4.54414 4.46998 4.37284 4.2481 4.09015 3.89208 3.64531 3.3391 2.95993 2.49064 1.9092 1.187 0.286521 -0.842164 -2.26645 -4.07891 -6.40918 -9.44267 -13.4514 -18.8469 -26.2729 -36.7814 -52.1809 -75.7921 -114.246 -182.599 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5727766927661e-19 2.40147051316992e-19 3.07885477225878e-19 3.65586266522754e-19 4.1576804087626797e-19 4.599384484990139e-19 4.991004519638759e-19 5.339718264028859e-19 5.650876988118e-19 5.9286944164536e-19 6.176487054668039e-19 6.3970106465718e-19 6.592524261218819e-19 6.764982554102579e-19 6.916003723623419e-19 7.04704575051828e-19 7.15934231079534e-19 7.254014928098399e-19 7.33202490840786e-19 7.39426947063876e-19 7.44151765957542e-19 7.474490454703139e-19 7.493860770208199e-19 7.5001893679125e-19 7.49334807368532e-19 7.471125883771739e-19 7.43067092376324e-19 7.368506470364039e-19 7.280514929624758e-19 7.161697510447319e-19 7.006062072220559e-19 6.806206558895399e-19 6.553142759555101e-19 6.23579963365872e-19 5.84043050568654e-19 5.3498279985894e-19 4.74233068427562e-19 3.9904452117057595e-19 3.0588756296328e-19 1.9017836645579998e-19 4.59057251350314e-20 -1.349295482795976e-19 -3.6312532321292993e-19 -6.535134294188939e-19 -1.026863843910012e-18 -1.5128825236572779e-18 -2.1551518774587597e-18 -3.01960628033346e-18 -4.209382648741859e-18 -5.8930299645807595e-18 -8.36030187210906e-18 -1.214323316617914e-17 -1.8304227172796397e-17 -2.9255585119176594e-17 ] } }