{ "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" [ "W" "W" "W" "W" ] } "a" { "source-value" [ 5.89052 5.495833 5.251221 5.073498 4.933829 4.818758 4.720904 4.635779 4.56045 4.492892 4.431652 4.375649 4.324056 4.276229 4.231656 4.189923 4.150688 4.11367 4.078631 4.045371 4.013718 3.983522 3.954657 3.92701 3.908188 3.88838 3.867474 3.845343 3.821834 3.796765 3.769912 3.741003 3.709696 3.675559 3.638026 3.596348 3.549493 3.495992 3.433642 3.358924 3.265685 3.14161 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.890520000000001e-10 5.495833e-10 5.251221e-10 5.073498e-10 4.933829e-10 4.818758e-10 4.720904e-10 4.6357790000000007e-10 4.5604500000000005e-10 4.4928920000000006e-10 4.431652e-10 4.3756490000000005e-10 4.324056e-10 4.276229e-10 4.2316560000000004e-10 4.1899230000000003e-10 4.1506879999999997e-10 4.11367e-10 4.078631e-10 4.0453710000000004e-10 4.013718e-10 3.983522e-10 3.954657e-10 3.92701e-10 3.9081880000000003e-10 3.88838e-10 3.8674740000000003e-10 3.8453430000000004e-10 3.821834e-10 3.7967650000000005e-10 3.7699120000000003e-10 3.741003e-10 3.7096960000000004e-10 3.675559e-10 3.6380260000000003e-10 3.596348e-10 3.5494930000000003e-10 3.495992e-10 3.433642e-10 3.358924e-10 3.2656850000000003e-10 3.1416100000000004e-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" [ 1.54375 3.37713 4.51339 5.33894 5.98772 6.52224 6.97679 7.37221 7.70954 7.94042 8.09812 8.2119 8.30299 8.38023 8.44773 8.50762 8.56089 8.60786 8.64846 8.68246 8.7095 8.72924 8.74132 8.74541 8.74334 8.73635 8.72301 8.70126 8.66807 8.61928 8.54915 8.44963 8.3092 8.1111 7.83023 7.42788 6.85136 6.01404 4.74088 2.68943 -0.891181 -8.26031 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.4733601787375e-19 5.41075877598042e-19 7.231247998129259e-19 8.553924918327959e-19 9.59338507493448e-19 1.044978052934016e-18 1.117804991832486e-18 1.181158260294114e-18 1.2352044846888359e-18 1.272195538814628e-18 1.2974618643328079e-18 1.31569143007446e-18 1.3302856570335658e-18 1.3426608693545819e-18 1.353475561634082e-18 1.3630709974951078e-18 1.371605792424426e-18 1.379131216074324e-18 1.3856360532083639e-18 1.3910834537639641e-18 1.3954157393823e-18 1.398578436057816e-18 1.4005138654316878e-18 1.4011691556749938e-18 1.400837505111756e-18 1.39971758364459e-18 1.397580280014834e-18 1.3940955458358838e-18 1.388777921587638e-18 1.380960901790352e-18 1.3697248370561097e-18 1.3537799751945421e-18 1.33128060872328e-18 1.2995414896037399e-18 1.254541154484582e-18 1.1900775776155918e-18 1.097708890312224e-18 9.63555436394136e-19 7.595727160597919e-19 4.30894190477862e-19 -1.427829374864754e-19 -1.323447567159654e-18 ] } }