{ "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" [ "Ti" ] } "a" { "source-value" [ 3.93565 3.671948 3.508515 3.389773 3.296456 3.219573 3.154194 3.09732 3.04699 3.001853 2.960937 2.923519 2.889048 2.857094 2.827313 2.79943 2.773216 2.748483 2.725073 2.702851 2.681702 2.661528 2.642242 2.62377 2.611195 2.59796 2.583992 2.569206 2.553499 2.536749 2.518808 2.499493 2.478576 2.455768 2.430691 2.402844 2.371539 2.335794 2.294136 2.244214 2.181918 2.09902 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.9356500000000003e-10 3.6719480000000003e-10 3.508515e-10 3.389773e-10 3.2964560000000004e-10 3.219573e-10 3.154194e-10 3.09732e-10 3.0469900000000004e-10 3.0018530000000003e-10 2.960937e-10 2.923519e-10 2.889048e-10 2.857094e-10 2.827313e-10 2.7994300000000004e-10 2.773216e-10 2.748483e-10 2.7250730000000004e-10 2.702851e-10 2.6817020000000003e-10 2.661528e-10 2.642242e-10 2.62377e-10 2.611195e-10 2.59796e-10 2.583992e-10 2.569206e-10 2.553499e-10 2.536749e-10 2.518808e-10 2.4994930000000004e-10 2.478576e-10 2.455768e-10 2.430691e-10 2.4028440000000003e-10 2.371539e-10 2.335794e-10 2.294136e-10 2.244214e-10 2.181918e-10 2.0990199999999999e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.37622 1.74238 2.02375 2.55766 2.83001 3.02201 3.18415 3.32264 3.4415 3.54369 3.63148 3.70668 3.7707 3.84151 3.9205 3.99049 4.04703 4.09063 4.1234 4.14754 4.16482 4.1765 4.18327 4.18547 4.18441 4.18093 4.1745 4.16445 4.1499 4.12975 4.10252 4.06627 4.01833 3.95501 3.87099 3.75848 3.60553 3.39288 3.08763 2.62869 1.88886 0.552897 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.20494752724348e-19 2.79160052354892e-19 3.2424049630575003e-19 4.0978230897164395e-19 4.53417589598634e-19 4.8417938097143395e-19 5.1015707291511e-19 5.32345617119376e-19 5.513890885910999e-19 5.67761731613946e-19 5.81827240283832e-19 5.93875608571512e-19 6.0413274338238e-19 6.15477756127734e-19 6.281333493597e-19 6.393469836210659e-19 6.48405690309702e-19 6.553911804339419e-19 6.6064151326356e-19 6.64509167658036e-19 6.672777288815879e-19 6.691490711900999e-19 6.70233744771318e-19 6.705862236307979e-19 6.704163929075939e-19 6.69858835438962e-19 6.688286358633e-19 6.6721844834613e-19 6.648872813436599e-19 6.616588954261499e-19 6.57296168451768e-19 6.51488278153518e-19 6.438074433701219e-19 6.336624609236339e-19 6.202009728447659e-19 6.02174883535632e-19 5.776695919186019e-19 5.4359930579659195e-19 4.94692864043742e-19 4.21162569602946e-19 3.02628735689724e-19 8.858386544086978e-20 ] } }