{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P3m1" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0.698742 ] [ 0.333333 0.666667 0.729647 ] [ 0.853172 0.146828 0.252181 ] [ 0.293655 0.146828 0.252181 ] [ 0.853172 0.706345 0.252181 ] [ 0.666667 0.333333 0.060156 ] [ 0.666942 0.833471 0.014257 ] [ 0.166529 0.333058 0.014257 ] [ 0.166529 0.833471 0.014257 ] [ 0 0 0.53341 ] [ 0.508 0.492 0.47691 ] [ 0.508 0.015999 0.47691 ] [ 0.984001 0.492 0.47691 ] ] } "species" { "source-value" [ "Li" "In" "Mo" "Mo" "Mo" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 5.84760047703 "source-unit" "angstrom" } "c" { "source-value" 5.09097262 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.666962113846154 "source-unit" "eV" } }