{ "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" [ "U" "U" "U" "U" ] } "a" { "source-value" [ 8.08653 7.544703 7.2089 6.964921 6.773183 6.615213 6.480879 6.364019 6.260607 6.167864 6.083794 6.006912 5.936085 5.870429 5.809239 5.751947 5.698086 5.647267 5.599166 5.553506 5.510052 5.4686 5.428974 5.39102 5.365182 5.337988 5.309289 5.278907 5.246634 5.212219 5.175355 5.135669 5.092691 5.045826 4.994301 4.937085 4.872764 4.799317 4.713723 4.611149 4.483151 4.31282 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.08653e-10 7.544703000000001e-10 7.2089e-10 6.964921000000001e-10 6.773183000000001e-10 6.615213e-10 6.480879e-10 6.364019e-10 6.260607e-10 6.167864e-10 6.083794e-10 6.006912e-10 5.936085e-10 5.870429e-10 5.809239e-10 5.751947000000001e-10 5.698086e-10 5.647267000000001e-10 5.599166e-10 5.553505999999999e-10 5.510052000000001e-10 5.4686e-10 5.428974000000001e-10 5.39102e-10 5.365182e-10 5.337988e-10 5.309289e-10 5.278907e-10 5.246634000000001e-10 5.212219000000001e-10 5.175355e-10 5.135669000000001e-10 5.092691000000001e-10 5.045826e-10 4.994301e-10 4.937085e-10 4.872764e-10 4.799317e-10 4.713723e-10 4.6111490000000003e-10 4.4831510000000005e-10 4.3128200000000005e-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" [ 0.997134 1.48992 1.92599 2.32505 2.69581 3.04266 3.36961 3.67728 3.96631 4.23796 4.49197 4.72837 4.94733 5.14902 5.33284 5.49858 5.64599 5.77518 5.88537 5.97622 6.04732 6.0986 6.1302 6.14082 6.13547 6.11746 6.08318 6.02784 5.94504 5.82606 5.65882 5.42626 5.10388 4.6557 4.02483 3.12162 1.79632 -0.218146 -3.43239 -8.93966 -19.4412 -43.3551 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5975847826047873e-19 2.387114990862336e-19 3.0857761498945924e-19 3.72514075219104e-19 4.319163756118848e-19 4.874878717043328e-19 5.398710363213888e-19 5.891652044135424e-19 6.354729152845248e-19 6.789960431885569e-19 7.196929315334977e-19 7.575683868492096e-19 7.926496461382465e-19 8.249639464031617e-19 8.544151570467073e-19 8.809696323598463e-19 9.045873179270592e-19 9.252858376911744e-19 9.429402218757696e-19 9.574959964757377e-19 9.688874722496256e-19 9.77103433961088e-19 9.82166312082816e-19 9.838678236541055e-19 9.830106591619777e-19 9.80125139067917e-19 9.746328776118144e-19 9.657664321923073e-19 9.525004097720833e-19 9.334377123378048e-19 9.066429105315458e-19 8.693826910382209e-19 8.177317211368705e-19 7.459253693458561e-19 6.448488528694463e-19 5.001386583021696e-19 2.878021907475456e-19 -3.4950842112103684e-20 -5.499295011467712e-19 -1.4322914249900929e-18 -3.1148236120296958e-18 -6.946252761244609e-18 ] } }