{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Nb" ] } "a" { "source-value" [ 4.68372 4.369893 4.175396 4.034084 3.923029 3.831533 3.753726 3.686041 3.626145 3.572428 3.523735 3.479205 3.438182 3.400154 3.364713 3.331529 3.300333 3.270898 3.243038 3.216592 3.191424 3.167415 3.144463 3.12248 3.100256 3.077354 3.053732 3.029342 3.004133 2.978048 2.951024 2.922991 2.89387 2.863575 2.832005 2.799049 2.76458 2.728452 2.690498 2.650522 2.608297 2.563556 2.515978 2.46518 2.410694 2.351943 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.68372e-10 4.3698930000000004e-10 4.175396e-10 4.034084e-10 3.923029e-10 3.831533e-10 3.753726e-10 3.686041e-10 3.6261450000000004e-10 3.572428e-10 3.5237349999999997e-10 3.479205e-10 3.438182e-10 3.400154e-10 3.3647130000000003e-10 3.3315290000000003e-10 3.300333e-10 3.270898e-10 3.243038e-10 3.216592e-10 3.1914240000000004e-10 3.167415e-10 3.144463e-10 3.12248e-10 3.100256e-10 3.0773540000000005e-10 3.0537320000000004e-10 3.0293420000000005e-10 3.004133e-10 2.978048e-10 2.951024e-10 2.9229910000000004e-10 2.8938700000000005e-10 2.863575e-10 2.832005e-10 2.7990490000000005e-10 2.7645800000000003e-10 2.728452e-10 2.690498e-10 2.650522e-10 2.608297e-10 2.5635560000000003e-10 2.515978e-10 2.4651800000000003e-10 2.410694e-10 2.351943e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 4.66694 7.00364 9.0524 10.9267 12.6677 14.3041 15.8434 17.2912 18.6563 19.9361 21.1321 22.2498 23.2843 24.2352 25.1021 25.8845 26.5801 27.1876 27.7054 28.1347 28.471 28.7122 28.8564 28.9018 28.8452 28.6557 28.2985 27.729 26.8907 25.7109 24.0956 21.9221 19.0303 15.2054 10.1608 3.51437 -5.27723 -16.9565 -32.5866 -53.6972 -82.5467 -122.533 -178.918 -260.098 -379.938 -562.26 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 7.47726222027996e-19 1.122106836094776e-18 1.45035437616216e-18 1.7506503426727798e-18 2.02958929465218e-18 2.29176947903994e-18 2.53839252831156e-18 2.77035566138208e-18 2.98906879368942e-18 3.19411535930874e-18 3.38573568473514e-18 3.56481096711732e-18 3.73055613990462e-18 3.882907116031679e-18 4.02179980843314e-18 4.1471541082773e-18 4.25860151493834e-18 4.3559337454538394e-18 4.4388944515623595e-18 4.507675894459979e-18 4.5615570946613995e-18 4.60020159507348e-18 4.62330498213576e-18 4.63057886405412e-18 4.621510544305679e-18 4.5911492970913795e-18 4.5339195477249e-18 4.442675588418599e-18 4.308365121190379e-18 4.1193403219110595e-18 3.86054073022104e-18 3.51230763882114e-18 3.04899019980102e-18 2.4361736590623596e-18 1.6279396342747198e-18 5.630641497230579e-19 -8.45505459824382e-19 -2.7167308094420994e-18 -5.220948910150439e-18 -8.60323991512248e-18 -1.3225439395380779e-17 -1.96319509493922e-17 -2.86658239002012e-17 -4.16722938150132e-17 -6.087277859686919e-17 -9.0083983423284e-17 ] } }