{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P6_3/mmc" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0 0.5 ] [ 0.666667 0.333333 0.75 ] [ 0.333333 0.666667 0.25 ] [ 0.333333 0.666667 0.415012 ] [ 0.666667 0.333333 0.915012 ] [ 0.333333 0.666667 0.084988 ] [ 0.666667 0.333333 0.584988 ] ] } "species" { "source-value" [ "Al" "Al" "Cu" "Cu" "O" "O" "O" "O" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 2.87679801202 "source-unit" "angstrom" } "c" { "source-value" 11.39794661 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.50691768625 "source-unit" "eV" } }