{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-31m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0.235112 0.235112 0.804886 ] [ 0.235112 0 0.195114 ] [ 0 0.764888 0.804886 ] [ 0 0.235112 0.195114 ] [ 0.764888 0.764888 0.195114 ] [ 0.764888 0 0.804886 ] [ 0 0.62295 0.676994 ] [ 0 0.37705 0.323006 ] [ 0.37705 0 0.323006 ] [ 0.62295 0 0.676994 ] [ 0.62295 0.62295 0.323006 ] [ 0.37705 0.37705 0.676994 ] ] } "species" { "source-value" [ "Co" "H" "H" "H" "C" "C" "C" "C" "C" "C" "N" "N" "N" "N" "N" "N" ] } "a" { "source-value" 6.48615014618 "source-unit" "angstrom" } "c" { "source-value" 5.59148743 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 7.358845978125 "source-unit" "eV" } }