{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P6_3mc" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0.500269 ] [ 0.333333 0.666667 0.000269 ] [ 0.333333 0.666667 0.280488 ] [ 0.666667 0.333333 0.780488 ] [ 0.666667 0.333333 0.932305 ] [ 0.333333 0.666667 0.432305 ] [ 0.666667 0.333333 0.673138 ] [ 0.333333 0.666667 0.173138 ] ] } "species" { "source-value" [ "Cu" "Cu" "C" "C" "S" "S" "N" "N" ] } "a" { "source-value" 3.83999449809 "source-unit" "angstrom" } "c" { "source-value" 10.95317163 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.2909562175 "source-unit" "eV" } }