{ "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" [ "Mg" "Mg" ] } "a" { "source-value" [ 5.34497 4.986837 4.76488 4.603616 4.476883 4.372469 4.283677 4.206436 4.138084 4.076783 4.021215 3.970398 3.923583 3.880186 3.839742 3.801873 3.766272 3.732683 3.700889 3.670709 3.641987 3.614589 3.588397 3.56331 3.546232 3.528257 3.509288 3.489207 3.467875 3.445127 3.420762 3.39453 3.366123 3.335147 3.30109 3.263272 3.220757 3.172211 3.115635 3.047837 2.963234 2.85065 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.34497e-10 4.986837e-10 4.76488e-10 4.603616e-10 4.476883e-10 4.372469e-10 4.2836770000000003e-10 4.206436e-10 4.1380840000000005e-10 4.076783e-10 4.021215e-10 3.970398e-10 3.923583e-10 3.8801860000000004e-10 3.839742e-10 3.801873e-10 3.766272e-10 3.732683e-10 3.700889e-10 3.6707090000000003e-10 3.641987e-10 3.614589e-10 3.5883970000000003e-10 3.56331e-10 3.546232e-10 3.5282570000000004e-10 3.5092880000000003e-10 3.489207e-10 3.467875e-10 3.445127e-10 3.420762e-10 3.3945300000000003e-10 3.366123e-10 3.335147e-10 3.30109e-10 3.2632720000000004e-10 3.220757e-10 3.172211e-10 3.1156350000000004e-10 3.047837e-10 2.963234e-10 2.85065e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.335039 0.502199 0.636395 0.749216 0.846321 0.931059 1.00564 1.07162 1.13016 1.18216 1.22833 1.26924 1.30536 1.33711 1.36482 1.38878 1.40926 1.42647 1.44061 1.45187 1.46039 1.46633 1.4698 1.47094 1.47039 1.46858 1.46521 1.45994 1.45227 1.4416 1.42712 1.40774 1.38198 1.34774 1.30204 1.24042 1.15602 1.03769 0.866223 0.605596 0.179944 -0.602494 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.3679165727872593e-20 8.046115034181659e-20 1.01961719899443e-19 1.2003763690189438e-19 1.355955731063514e-19 1.491720974675406e-19 1.61121291021576e-19 1.71692452452708e-19 1.81071594468144e-19 1.89402912964944e-19 1.9680016248412197e-19 2.0335466709381598e-19 2.09141729095824e-19 2.14228639908774e-19 2.18668271361588e-19 2.22507086576652e-19 2.25788344323084e-19 2.2854569031019797e-19 2.3081116807067396e-19 2.3261521896055798e-19 2.3398027345272597e-19 2.34931966373322e-19 2.3548792166532e-19 2.3567056980159596e-19 2.35582450086726e-19 2.3529245611597196e-19 2.34752522590314e-19 2.33908175504196e-19 2.32679306025918e-19 2.3096978355744e-19 2.28649831791408e-19 2.25544813474716e-19 2.21417606465532e-19 2.1593175367071597e-19 2.08609806453336e-19 1.98737194034628e-19 1.85214823243668e-19 1.66256267133546e-19 1.3878422504333818e-19 9.70271760843864e-20 2.88302072228496e-20 -9.653018089251959e-20 ] } }