{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Sn" "Sn" ] } "a" { "source-value" [ 5.76993 5.383323 5.14372 4.969635 4.832826 4.720111 4.62426 4.540878 4.467091 4.400917 4.340931 4.286073 4.235537 4.188689 4.145029 4.10415 4.065719 4.029458 3.995137 3.962558 3.931552 3.901975 3.873701 3.84662 3.828184 3.80878 3.788303 3.766625 3.743598 3.719041 3.692738 3.664421 3.633756 3.600317 3.563552 3.522727 3.476832 3.424427 3.363353 3.290164 3.198835 3.0773 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.76993e-10 5.383323000000001e-10 5.143720000000001e-10 4.969635000000001e-10 4.832826e-10 4.720111e-10 4.62426e-10 4.5408780000000005e-10 4.467091e-10 4.400917e-10 4.3409310000000005e-10 4.286073e-10 4.235537e-10 4.1886890000000003e-10 4.145029e-10 4.1041499999999997e-10 4.0657189999999996e-10 4.029458e-10 3.9951370000000004e-10 3.9625580000000004e-10 3.931552e-10 3.9019750000000004e-10 3.873701e-10 3.84662e-10 3.828184e-10 3.80878e-10 3.788303e-10 3.766625e-10 3.7435980000000003e-10 3.719041e-10 3.692738e-10 3.6644210000000003e-10 3.6337560000000004e-10 3.600317e-10 3.563552e-10 3.5227270000000005e-10 3.476832e-10 3.4244270000000004e-10 3.363353e-10 3.290164e-10 3.198835e-10 3.0773000000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.519087 0.908495 1.18495 1.42386 1.63388 1.82031 1.9868 2.13594 2.26973 2.38975 2.49726 2.59331 2.67876 2.75438 2.82081 2.87861 2.92828 2.97025 3.00492 3.03264 3.05373 3.06848 3.07716 3.08 3.07862 3.07405 3.06555 3.05217 3.03266 3.00542 2.96832 2.91846 2.85189 2.76302 2.64377 2.48207 2.25916 1.94439 1.48442 0.778299 -0.389047 -2.56577 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 8.316690555612096e-20 1.455569449113696e-19 1.89849918681696e-19 2.281275203292288e-19 2.617764337192704e-19 2.916458124608448e-19 3.18320451020544e-19 3.4221531314315524e-19 3.636508341528384e-19 3.8288015795568e-19 4.001051588059008e-19 4.154940652486848e-19 4.2918466447342083e-19 4.413003240799104e-19 4.519435833718848e-19 4.612041642401089e-19 4.691621755156224e-19 4.7588651079312e-19 4.814412571374336e-19 4.858824907302912e-19 4.892614812235584e-19 4.916246917392385e-19 4.930153810460929e-19 4.934703992064e-19 4.932492988327296e-19 4.92517104117024e-19 4.911552539893441e-19 4.890115416707136e-19 4.858856950835328e-19 4.815213659684736e-19 4.7557729070530565e-19 4.675888380739968e-19 4.569231483093312e-19 4.426846046802817e-19 4.2357864847724163e-19 3.9767145251890567e-19 3.6195733346465284e-19 3.115256199717312e-19 2.3783030194479364e-19 1.246972461792019e-19 -6.233220077923776e-20 -4.110816708350016e-19 ] } }