{ "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 0.973239 ] [ 0.666667 0.333333 0.473239 ] [ 0 0 0 ] [ 0.333333 0.666667 0.526761 ] [ 0 0 0.25 ] [ 0.666667 0.333333 0.25 ] [ 0.666667 0.333333 0.026761 ] [ 0.333333 0.666667 0.75 ] [ 0 0 0.75 ] [ 0 0 0.5 ] [ 0.666667 0.333333 0.864954 ] [ 0.333333 0.666667 0.135046 ] [ 0.333333 0.666667 0.364954 ] [ 0.666667 0.333333 0.635046 ] ] } "species" { "source-value" [ "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "W" "W" "W" "W" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 3.10174565963 "source-unit" "angstrom" } "c" { "source-value" 14.28969497 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 8.208861247857142 "source-unit" "eV" } }