{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-3m1" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.267992 ] [ 0 0 0 ] [ 0 0 0.732008 ] [ 0.333333 0.666667 0.56185 ] [ 0.666667 0.333333 0.43815 ] [ 0.333333 0.666667 0.135423 ] [ 0.666667 0.333333 0.864577 ] [ 0.333333 0.666667 0.865944 ] [ 0.666667 0.333333 0.134056 ] [ 0.333333 0.666667 0.389383 ] [ 0.666667 0.333333 0.610617 ] ] } "species" { "source-value" [ "Ca" "Ca" "Ca" "Zn" "Zn" "Cu" "Cu" "P" "P" "P" "P" ] } "a" { "source-value" 4.04216205069 "source-unit" "angstrom" } "c" { "source-value" 14.7114515 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.280360782727272 "source-unit" "eV" } }