{ "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 0 0.25 ] [ 0 0 0.75 ] [ 0.333333 0.666667 0.152077 ] [ 0.666667 0.333333 0.652077 ] [ 0.666667 0.333333 0.847923 ] [ 0.333333 0.666667 0.347923 ] [ 0.333333 0.666667 0.609896 ] [ 0.666667 0.333333 0.109896 ] [ 0.666667 0.333333 0.390104 ] [ 0.333333 0.666667 0.890104 ] ] } "species" { "source-value" [ "Ca" "Ca" "Ca" "Ca" "Ga" "Ga" "Ga" "Ga" "Ge" "Ge" "Ge" "Ge" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 4.24428056341 "source-unit" "angstrom" } "c" { "source-value" 17.6425857 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.74688424 "source-unit" "eV" } }