{ "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" [ 5.99192 5.590439 5.341616 5.160834 5.018761 4.901708 4.80217 4.71558 4.638954 4.570234 4.507939 4.450972 4.39849 4.349841 4.304501 4.262049 4.222139 4.184483 4.148841 4.115009 4.08281 4.052095 4.022733 3.99461 3.975464 3.955315 3.934049 3.911537 3.887624 3.862123 3.834808 3.805401 3.773555 3.73883 3.700651 3.658256 3.610595 3.556173 3.492749 3.416745 3.321901 3.19569 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.991920000000001e-10 5.590439e-10 5.341616e-10 5.160834000000001e-10 5.018761e-10 4.901708e-10 4.80217e-10 4.715580000000001e-10 4.638954e-10 4.5702340000000004e-10 4.5079390000000006e-10 4.4509720000000003e-10 4.39849e-10 4.349841e-10 4.3045010000000003e-10 4.2620490000000005e-10 4.2221390000000004e-10 4.184483e-10 4.1488410000000003e-10 4.115009e-10 4.08281e-10 4.052095e-10 4.0227329999999996e-10 3.9946100000000004e-10 3.9754640000000003e-10 3.9553150000000004e-10 3.934049e-10 3.9115370000000003e-10 3.8876240000000005e-10 3.862123e-10 3.8348080000000005e-10 3.805401e-10 3.773555e-10 3.7388300000000003e-10 3.7006510000000004e-10 3.658256e-10 3.610595e-10 3.556173e-10 3.492749e-10 3.416745e-10 3.321901e-10 3.19569e-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" [ 1.6158 1.98383 2.23717 2.42714 2.56999 2.68448 2.7781 2.85559 2.92021 2.97439 3.0203 3.06145 3.10444 3.14965 3.18612 3.21235 3.23215 3.24771 3.25998 3.26946 3.27647 3.28124 3.28399 3.28486 3.28445 3.28315 3.28073 3.27703 3.2719 3.26529 3.25747 3.24903 3.23928 3.22455 3.20135 3.16812 3.12276 3.06093 2.97563 2.8629 2.71882 2.43716 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.58879698388864e-19 3.178446045641664e-19 3.584341470755136e-19 3.8887069634085123e-19 4.1175778936897926e-19 4.301011095005185e-19 4.45100687024448e-19 4.575159536590272e-19 4.678692189826368e-19 4.765498119141312e-19 4.8390540478022405e-19 4.90498361574816e-19 4.973861188676352e-19 5.04629559370272e-19 5.104726975063296e-19 5.14675206782688e-19 5.17847516491872e-19 5.203405033138368e-19 5.223063740275585e-19 5.238252374640769e-19 5.249483632752577e-19 5.257126015233792e-19 5.261532000940992e-19 5.262925894601089e-19 5.2622690021865605e-19 5.26018617257952e-19 5.256308905157185e-19 5.250380851660224e-19 5.24216168559552e-19 5.231571298132032e-19 5.219042276957377e-19 5.205519906277824e-19 5.1898986842250245e-19 5.16629862260064e-19 5.129128124998081e-19 5.075887795888896e-19 5.003213064369408e-19 4.9041504839053445e-19 4.767484818151105e-19 4.58687144768832e-19 4.356029840163456e-19 3.9047607731489283e-19 ] } }