{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Mo" ] } "a" { "source-value" [ 3.79926 3.544696 3.386927 3.272299 3.182216 3.107997 3.044884 2.98998 2.941394 2.897822 2.858323 2.822202 2.788926 2.758079 2.72933 2.702413 2.677107 2.653232 2.630632 2.60918 2.588764 2.569289 2.550672 2.53284 2.5207 2.507924 2.49444 2.480166 2.465003 2.448834 2.431514 2.412868 2.392676 2.370658 2.34645 2.319568 2.289348 2.254841 2.214626 2.166434 2.106296 2.02627 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.79926e-10 3.5446960000000005e-10 3.3869270000000003e-10 3.272299e-10 3.182216e-10 3.107997e-10 3.044884e-10 2.9899800000000004e-10 2.941394e-10 2.8978220000000004e-10 2.858323e-10 2.822202e-10 2.788926e-10 2.758079e-10 2.7293300000000003e-10 2.702413e-10 2.677107e-10 2.653232e-10 2.630632e-10 2.60918e-10 2.588764e-10 2.569289e-10 2.550672e-10 2.53284e-10 2.5207000000000004e-10 2.507924e-10 2.49444e-10 2.4801660000000004e-10 2.4650029999999997e-10 2.4488340000000004e-10 2.431514e-10 2.412868e-10 2.392676e-10 2.3706580000000005e-10 2.34645e-10 2.3195679999999998e-10 2.289348e-10 2.254841e-10 2.214626e-10 2.1664340000000004e-10 2.106296e-10 2.0262699999999998e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.384549 1.11329 1.61232 2.01061 2.3221 2.52898 2.66265 2.76258 2.86144 2.97835 3.11992 3.28402 3.46369 3.65002 3.83413 4.00832 4.16656 4.30344 4.41135 4.49278 4.55138 4.59027 4.61208 4.61895 4.61576 4.60546 4.58678 4.5581 4.51734 4.4618 4.38794 4.29101 4.1646 3.99981 3.78417 3.49961 3.11934 2.60202 1.87714 0.813681 -0.853252 -3.76443 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 6.161154173520192e-20 1.783687210170432e-19 2.583221409248256e-19 3.221352335546688e-19 3.72041433115968e-19 4.051872630470784e-19 4.2660355793731206e-19 4.426141089089664e-19 4.584532269821952e-19 4.77184273855968e-19 4.998662882766337e-19 5.261580066239616e-19 5.549443139698753e-19 5.847976709452416e-19 6.142953447107905e-19 6.422036592685057e-19 6.675565021160448e-19 6.894870957015553e-19 7.06776183616608e-19 7.198227078397824e-19 7.292114628376705e-19 7.354423277159617e-19 7.389366749259264e-19 7.40037370264416e-19 7.395262759223808e-19 7.3787603400295685e-19 7.348831680753024e-19 7.30288125526848e-19 7.237576536204672e-19 7.148591646685441e-19 7.030254881473153e-19 6.874955901619008e-19 6.67242475498368e-19 6.408402069642048e-19 6.062908703132737e-19 5.606993323917889e-19 4.997733620326272e-19 4.1688956108540163e-19 3.0075098219685123e-19 1.303660674989165e-19 -1.3670604060508417e-19 -6.031281736638144e-19 ] } }