{ "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" [ "Fr" "Fr" ] } "a" { "source-value" [ 8.58535 8.0101 7.653584 7.394555 7.190991 7.023276 6.880655 6.756588 6.646797 6.548333 6.459077 6.377453 6.302257 6.232551 6.167587 6.106761 6.049577 5.995624 5.944555 5.896079 5.849945 5.805936 5.763865 5.72357 5.682833 5.640853 5.597552 5.552845 5.506636 5.458822 5.409287 5.357901 5.304523 5.24899 5.191122 5.130714 5.067531 5.001308 4.931737 4.85846 4.781061 4.699049 4.611837 4.518724 4.41885 4.311157 4.194315 4.066626 3.925867 3.769054 3.592047 3.388865 3.150404 2.86178 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.585350000000001e-10 8.0101e-10 7.653584e-10 7.394555000000001e-10 7.190991000000001e-10 7.023276000000001e-10 6.880655e-10 6.756588000000001e-10 6.646797e-10 6.548333e-10 6.459077e-10 6.377453e-10 6.302257e-10 6.232551000000001e-10 6.167587e-10 6.106761e-10 6.049577e-10 5.995624000000001e-10 5.944555e-10 5.896079e-10 5.849945000000001e-10 5.805936000000001e-10 5.763865e-10 5.72357e-10 5.682832999999999e-10 5.640853e-10 5.597552000000001e-10 5.552845e-10 5.506636e-10 5.458822e-10 5.409287e-10 5.357901e-10 5.304523e-10 5.24899e-10 5.191122000000001e-10 5.130714e-10 5.067531e-10 5.001308e-10 4.931737e-10 4.85846e-10 4.781061e-10 4.699049e-10 4.6118370000000005e-10 4.518724e-10 4.41885e-10 4.311157e-10 4.194315e-10 4.066626e-10 3.925867e-10 3.7690540000000003e-10 3.592047e-10 3.3888650000000003e-10 3.150404e-10 2.86178e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.483377 0.723457 0.934952 1.12863 1.30869 1.47771 1.63671 1.78618 1.92661 2.05827 2.1815 2.29618 2.40231 2.50013 2.58963 2.67064 2.74275 2.8058 2.85964 2.90408 2.939 2.9643 2.97964 2.9848 2.97898 2.95956 2.92305 2.86492 2.77925 2.65854 2.49311 2.27039 1.97391 1.58161 1.064 0.381706 -0.520652 -1.72017 -3.32561 -5.494 -8.45698 -12.5642 -18.3572 -26.6988 -39.0121 -57.7459 -87.3138 -136.145 -221.492 -381.891 -713.492 -1494.07 -3706.53 -12046.2 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 7.74455334813018e-20 1.1591059011037379e-19 1.497958248311568e-19 1.8082646144314198e-19 2.0967525391494596e-19 2.36755243382814e-19 2.62229851863414e-19 2.8617758601181198e-19 3.0867695248307397e-19 3.2977121004631795e-19 3.495148327071e-19 3.67888594345812e-19 3.84892494962454e-19 4.00564986796242e-19 4.1490446767054197e-19 4.2788370058257597e-19 4.3943699629035e-19 4.4953871996772e-19 4.58164838965176e-19 4.65284911926672e-19 4.708797127326e-19 4.7493321961662e-19 4.773909585731759e-19 4.782176817163199e-19 4.772852149153319e-19 4.74173787892104e-19 4.683242410013699e-19 4.59010788227928e-19 4.4528494100445e-19 4.2594506685543596e-19 3.99440258799174e-19 3.63756580806726e-19 3.1625524796189397e-19 2.53401858610074e-19 1.704715938576e-19 6.115604342576039e-20 -8.341764688453679e-20 -2.75601618050778e-19 -5.32821463579674e-19 -8.802358427195999e-19 -1.354957575020532e-18 -2.01300676649028e-18 -2.9411476905664797e-18 -4.2776193515839196e-18 -6.250427506327139e-18 -9.25191316893006e-18 -1.398921301857492e-17 -2.1812833783593e-17 -3.5486930701792795e-17 -6.11856836934894e-17 -1.143140210945928e-16 -2.3937640435603797e-16 -5.93851575922002e-16 -1.93001401684908e-15 ] } }