{ "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" [ [ 0.333333 0.666667 0.4389 ] [ 0.666667 0.333333 0.9389 ] [ 0.666667 0.333333 0.5611 ] [ 0.333333 0.666667 0.0611 ] [ 0.168814 0.337628 0.75 ] [ 0.831186 0.168814 0.25 ] [ 0.337628 0.168814 0.25 ] [ 0.662372 0.831186 0.75 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.831186 0.662372 0.25 ] [ 0.168814 0.831186 0.75 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 5.06421084106 "source-unit" "angstrom" } "c" { "source-value" 8.0251214 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.0255402458333336 "source-unit" "eV" } }