{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.421825 0.5 ] [ 0.578175 0.578175 0.5 ] [ 0.421825 0 0.5 ] [ 0 0.772468 0 ] [ 0.227532 0.227532 0 ] [ 0.772468 0 0 ] [ 0 0 0.5 ] [ 0.333333 0.666667 0 ] [ 0.666667 0.333333 0 ] ] } "species" { "source-value" [ "Sc" "Sc" "Sc" "Fe" "Fe" "Fe" "Ge" "Ge" "Ge" ] } "a" { "source-value" 6.49608735 "source-unit" "angstrom" } "c" { "source-value" 3.96121058 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 7.028305992222222 "source-unit" "eV" } }