{ "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 0.5 ] [ 0 0 0 ] [ 0.333333 0.666667 0.790262 ] [ 0.666667 0.333333 0.209738 ] ] } "species" { "source-value" [ "Na" "Ti" "S" "S" ] } "a" { "source-value" 3.5547 "source-unit" "angstrom" } "c" { "source-value" 6.79737305 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 5.7113733425 "source-unit" "eV" } }