{ "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" [ [ 0.333333 0.666667 0.433058 ] [ 0.666667 0.333333 0.566942 ] [ 0.666667 0.333333 0.933058 ] [ 0.333333 0.666667 0.066942 ] [ 0.170918 0.341836 0.75 ] [ 0.170918 0.829082 0.75 ] [ 0.341836 0.170918 0.25 ] [ 0.829082 0.658164 0.25 ] [ 0.658164 0.829082 0.75 ] [ 0 0 0 ] [ 0.829082 0.170918 0.25 ] [ 0 0 0.5 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 5.25630960833 "source-unit" "angstrom" } "c" { "source-value" 8.90036517 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 8.065905528333333 "source-unit" "eV" } }