{ "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/mcm" } "basis-atom-coordinates" { "source-value" [ [ 0.671361 0.671361 0.75 ] [ 0 0.671361 0.25 ] [ 0.671361 0 0.25 ] [ 0.328639 0 0.75 ] [ 0 0.328639 0.75 ] [ 0.328639 0.328639 0.25 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.333333 0.666667 0.75 ] [ 0.666667 0.333333 0.25 ] [ 0.666667 0.333333 0.75 ] [ 0.333333 0.666667 0.25 ] [ 0.343736 0 0.417158 ] [ 0.343736 0.343736 0.917158 ] [ 0 0.656264 0.917158 ] [ 0 0.343736 0.417158 ] [ 0.656264 0.656264 0.417158 ] [ 0.343736 0 0.082842 ] [ 0.656264 0.656264 0.082842 ] [ 0.656264 0 0.917158 ] [ 0 0.343736 0.082842 ] [ 0 0.656264 0.582842 ] [ 0.656264 0 0.582842 ] [ 0.343736 0.343736 0.582842 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "La" "La" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "a" { "source-value" 7.26073382076 "source-unit" "angstrom" } "c" { "source-value" 7.16530994 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.668944147083334 "source-unit" "eV" } }