{ "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" [ "Mn" ] } "a" { "source-value" [ 3.67823 3.431774 3.279031 3.168055 3.080841 3.008987 2.947883 2.894729 2.84769 2.805506 2.767265 2.732295 2.700078 2.670214 2.642381 2.616321 2.591822 2.568707 2.546827 2.526059 2.506293 2.487438 2.469414 2.45215 2.440397 2.428028 2.414974 2.401154 2.386475 2.37082 2.354053 2.336001 2.316452 2.295135 2.271699 2.245673 2.216416 2.183008 2.144074 2.097418 2.039197 1.96172 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.67823e-10 3.431774e-10 3.279031e-10 3.168055e-10 3.080841e-10 3.008987e-10 2.947883e-10 2.894729e-10 2.8476900000000003e-10 2.805506e-10 2.767265e-10 2.7322950000000004e-10 2.700078e-10 2.670214e-10 2.6423809999999997e-10 2.616321e-10 2.591822e-10 2.568707e-10 2.5468270000000003e-10 2.526059e-10 2.506293e-10 2.4874380000000003e-10 2.469414e-10 2.45215e-10 2.440397e-10 2.428028e-10 2.414974e-10 2.4011540000000003e-10 2.386475e-10 2.3708200000000004e-10 2.354053e-10 2.3360010000000003e-10 2.316452e-10 2.2951350000000002e-10 2.271699e-10 2.245673e-10 2.2164160000000002e-10 2.183008e-10 2.1440739999999998e-10 2.097418e-10 2.039197e-10 1.96172e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.567741 0.806926 1.02374 1.20711 1.36587 1.50521 1.62854 1.73827 1.82477 1.91092 1.988 2.05664 2.11758 2.17142 2.21871 2.25988 2.29532 2.32535 2.35023 2.37018 2.3854 2.39607 2.40237 2.40444 2.40343 2.40008 2.39384 2.38399 2.36958 2.34939 2.32179 2.28454 2.23457 2.16748 2.07689 1.95314 1.78107 1.53553 1.17196 0.602203 -0.376019 -2.33582 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 9.09621356869613e-20 1.292837971915661e-19 1.6402122937777923e-19 1.934003420733888e-19 2.188364981052096e-19 2.411612271394368e-19 2.609208714037632e-19 2.7850155546380163e-19 2.923603832337216e-19 3.061631348219136e-19 3.1851271221504004e-19 3.295100525402112e-19 3.392737168673664e-19 3.478998357937536e-19 3.5547652903351685e-19 3.6207269018135043e-19 3.677508041254656e-19 3.72562140517728e-19 3.765483559502784e-19 3.797446983087744e-19 3.8218321112563204e-19 3.838927335800256e-19 3.849021048511296e-19 3.8523375541163523e-19 3.8507193557293443e-19 3.8453520640496644e-19 3.835354481935872e-19 3.8195730422209918e-19 3.7964856771152643e-19 3.7641377311413124e-19 3.719917656407232e-19 3.6602365772824317e-19 3.5801758115410565e-19 3.472685782051584e-19 3.327544601973312e-19 3.1292752451493124e-19 2.853588714008256e-19 2.460190266537024e-19 1.877686912512768e-19 9.648355675756226e-20 -6.024488507765952e-20 -3.7423961943970564e-19 ] } }