{ "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" [ 6.10642 5.697268 5.443692 5.259455 5.114668 4.995379 4.893939 4.805694 4.727604 4.657571 4.594087 4.536031 4.482547 4.432968 4.386761 4.343498 4.302826 4.264451 4.228128 4.193649 4.160835 4.129534 4.099611 4.07095 4.051439 4.030903 4.009232 3.986289 3.961919 3.93593 3.908093 3.878124 3.84567 3.810281 3.771373 3.728167 3.679595 3.624133 3.559497 3.48204 3.385383 3.25676 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.10642e-10 5.697268000000001e-10 5.443692000000001e-10 5.259455e-10 5.114668e-10 4.995379e-10 4.893939e-10 4.805694e-10 4.727604000000001e-10 4.657571e-10 4.594087e-10 4.5360310000000007e-10 4.4825470000000003e-10 4.4329679999999997e-10 4.3867610000000003e-10 4.3434980000000004e-10 4.302826e-10 4.2644510000000005e-10 4.228128e-10 4.193649e-10 4.1608349999999995e-10 4.1295339999999995e-10 4.0996110000000004e-10 4.07095e-10 4.0514390000000006e-10 4.0309030000000004e-10 4.009232e-10 3.986289e-10 3.961919e-10 3.93593e-10 3.908093e-10 3.878124e-10 3.84567e-10 3.810281e-10 3.771373e-10 3.728167e-10 3.679595e-10 3.624133e-10 3.559497e-10 3.4820400000000003e-10 3.3853830000000003e-10 3.25676e-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 1.14391 1.78276 2.0205 2.21737 2.38402 2.52709 2.65108 2.75918 2.85379 2.93674 3.00948 3.07318 3.12881 3.17717 3.21892 3.25464 3.28484 3.30995 3.33033 3.34633 3.35825 3.36633 3.36912 3.36811 3.36516 3.36023 3.35305 3.34309 3.32955 3.31126 3.28667 3.25372 3.20965 3.15065 3.07112 2.96251 2.81113 2.5937 2.26728 1.74326 0.804622 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 1.8327458733989397e-19 2.8562964160298395e-19 3.2371978889970002e-19 3.5526184029325797e-19 3.81962113898868e-19 4.0488445500150593e-19 4.2474984308647194e-19 4.42069372500012e-19 4.57227565634286e-19 4.705176208133159e-19 4.82171853649032e-19 4.923777188076119e-19 5.01290627422554e-19 5.090387536245779e-19 5.15727841071528e-19 5.21450816008176e-19 5.26289389442856e-19 5.3031245497083e-19 5.33577690950922e-19 5.36141173565322e-19 5.3805096811305e-19 5.39345526833322e-19 5.39792534114208e-19 5.39630714274174e-19 5.39158072167144e-19 5.383681990865819e-19 5.3721783626337e-19 5.35622068335906e-19 5.334527211734699e-19 5.30522340109884e-19 5.265825877668779e-19 5.213034157578479e-19 5.1424262333181e-19 5.0478978119121e-19 4.92047670421008e-19 4.74646429999134e-19 4.503926801136419e-19 4.1555655356058e-19 3.63258303873552e-19 2.7930104389868397e-19 1.2891465676023478e-19 ] } }