{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" ] } "a" { "source-value" [ 6.26967 5.849579 5.589223 5.400061 5.251402 5.128925 5.024772 4.934168 4.853991 4.782085 4.716903 4.657295 4.602381 4.551476 4.504035 4.459615 4.417855 4.378454 4.34116 4.305759 4.272068 4.23993 4.209207 4.17978 4.150031 4.119374 4.087753 4.055104 4.021359 3.986442 3.950267 3.912742 3.873761 3.833207 3.790947 3.746833 3.700692 3.652331 3.601525 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.26967e-10 5.849579000000001e-10 5.589223e-10 5.400061e-10 5.251402e-10 5.128924999999999e-10 5.024771999999999e-10 4.934168e-10 4.853991e-10 4.782085000000001e-10 4.716903e-10 4.657295e-10 4.602381e-10 4.5514760000000004e-10 4.504035e-10 4.4596150000000004e-10 4.4178550000000005e-10 4.3784539999999997e-10 4.3411600000000007e-10 4.305759e-10 4.2720680000000003e-10 4.2399300000000003e-10 4.2092070000000005e-10 4.17978e-10 4.150031e-10 4.1193739999999997e-10 4.087753e-10 4.055104e-10 4.0213590000000006e-10 3.986442e-10 3.950267e-10 3.9127420000000003e-10 3.873761e-10 3.833207e-10 3.7909470000000003e-10 3.746833e-10 3.700692e-10 3.6523310000000005e-10 3.601525e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.243041 0.365523 0.466407 0.553197 0.629447 0.697226 0.757892 0.812401 0.861463 0.90563 0.945337 0.980942 1.01274 1.04099 1.06589 1.08764 1.1064 1.12231 1.1355 1.14608 1.15416 1.15983 1.16318 1.16428 1.16308 1.15918 1.15203 1.14098 1.12523 1.10384 1.07561 1.03909 0.992476 0.933526 0.859411 0.766556 0.65038 0.504982 0.322656 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.8939461130399396e-20 5.856324097895819e-20 7.47266397334038e-20 8.86319307398898e-20 1.008485275741398e-19 1.117079205817284e-19 1.214276853495528e-19 1.301609899638234e-19 1.380215889655542e-19 1.45097922504942e-19 1.514596852655658e-19 1.5716423517092279e-19 1.62258836431716e-19 1.66784985422766e-19 1.7077440524142599e-19 1.7425913942037598e-19 1.7726482278575998e-19 1.7981388581045397e-19 1.8192715679069997e-19 1.8362225966947198e-19 1.84916818389744e-19 1.8582525254122198e-19 1.86361981713612e-19 1.86538221143352e-19 1.8634595994727198e-19 1.85721111060012e-19 1.84575554766702e-19 1.8280514958613201e-19 1.8028172138758199e-19 1.7685466556745598e-19 1.72331720929674e-19 1.66480571862306e-19 1.590121857005784e-19 1.495673544431484e-19 1.3769282232025739e-19 1.2281581118525039e-19 1.0420236392209198e-19 8.090703609905881e-20 5.1695190401990395e-20 ] } }