{ "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" [ "Al" "Al" ] } "a" { "source-value" [ 4.85329 4.528102 4.326564 4.180136 4.065061 3.970252 3.889629 3.819493 3.757429 3.701768 3.651311 3.605169 3.562661 3.523256 3.486532 3.452147 3.419821 3.389322 3.360453 3.333049 3.306969 3.282091 3.258309 3.23553 3.220022 3.203701 3.186477 3.168243 3.148873 3.128218 3.106093 3.082274 3.05648 3.028353 2.997429 2.963089 2.924485 2.880404 2.829032 2.76747 2.690649 2.58842 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.85329e-10 4.5281019999999997e-10 4.326564e-10 4.1801360000000005e-10 4.065061e-10 3.970252e-10 3.889629e-10 3.819493e-10 3.7574290000000003e-10 3.701768e-10 3.6513110000000005e-10 3.605169e-10 3.562661e-10 3.523256e-10 3.486532e-10 3.4521470000000004e-10 3.4198210000000004e-10 3.389322e-10 3.3604530000000005e-10 3.333049e-10 3.306969e-10 3.282091e-10 3.2583090000000003e-10 3.23553e-10 3.220022e-10 3.2037010000000003e-10 3.186477e-10 3.168243e-10 3.148873e-10 3.128218e-10 3.106093e-10 3.0822740000000003e-10 3.05648e-10 3.028353e-10 2.997429e-10 2.963089e-10 2.924485e-10 2.880404e-10 2.829032e-10 2.76747e-10 2.690649e-10 2.58842e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.00824 1.4822 1.82205 2.05788 2.23524 2.38231 2.51113 2.62572 2.72743 2.81695 2.89509 2.96281 3.02109 3.07089 3.11307 3.14843 3.17768 3.20147 3.22033 3.23478 3.24529 3.25231 3.25627 3.25751 3.25694 3.25508 3.25171 3.24657 3.23929 3.22943 3.21635 3.1992 3.17677 3.14718 3.10749 3.05287 2.97483 2.85789 2.67257 2.36074 1.80397 0.722039 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.6153785561553922e-19 2.37474618734976e-19 2.91924591192864e-19 3.2970872244119043e-19 3.5812492698769924e-19 3.816881385498048e-19 4.0232737777895045e-19 4.206867196766976e-19 4.369824580868544e-19 4.51325143196256e-19 4.638445513111872e-19 4.746944913872448e-19 4.840319767332673e-19 4.920108163048512e-19 4.987687972913857e-19 5.044340938225344e-19 5.091204604383744e-19 5.129320386192577e-19 5.159537437260864e-19 5.1826888894314245e-19 5.199527765716032e-19 5.210775045594048e-19 5.217119665012417e-19 5.219106364022209e-19 5.218193123348352e-19 5.215213074833664e-19 5.209813739621568e-19 5.201578551790657e-19 5.1899147059912325e-19 5.174117244510144e-19 5.15316077431008e-19 5.12568344526336e-19 5.089746623658816e-19 5.042338217449345e-19 4.978747827369792e-19 4.891236940341696e-19 4.766203076854464e-19 4.578844542818112e-19 4.281929171451456e-19 3.782322435787392e-19 2.8902785586245764e-19 1.1568340051058112e-19 ] } }