{ "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" [ [ 0.666667 0.333333 0.068436 ] [ 0.333333 0.666667 0.931564 ] [ 0.333333 0.666667 0.568436 ] [ 0.666667 0.333333 0.431564 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.832164 0.664327 0.75 ] [ 0.167836 0.832164 0.25 ] [ 0.664327 0.832164 0.25 ] [ 0.335673 0.167836 0.75 ] [ 0.832164 0.167836 0.75 ] [ 0.167836 0.335673 0.25 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Li" "Li" "Au" "Au" "Au" "Au" "Au" "Au" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 5.61838541415 "source-unit" "angstrom" } "c" { "source-value" 8.83478829 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 2.8308144391666663 "source-unit" "eV" } }