{ "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" [ [ 0.403679 0 0.75 ] [ 0.403679 0.403679 0.25 ] [ 0 0.596321 0.25 ] [ 0 0.403679 0.75 ] [ 0.596321 0.596321 0.75 ] [ 0.596321 0 0.25 ] [ 0.666667 0.333333 0 ] [ 0.333333 0.666667 0.5 ] [ 0.666667 0.333333 0.5 ] [ 0.333333 0.666667 0 ] [ 0.774058 0 0.75 ] [ 0.774058 0.774058 0.25 ] [ 0 0.225942 0.25 ] [ 0 0.774058 0.75 ] [ 0.225942 0.225942 0.75 ] [ 0.225942 0 0.25 ] [ 0 0 0.5 ] [ 0 0 0 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Mo" "Mo" "Mo" "Mo" "Mo" "Mo" "Mo" "Mo" "Mo" "Mo" "C" "C" ] } "a" { "source-value" 7.46969780286 "source-unit" "angstrom" } "c" { "source-value" 5.34118124 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 8.669630672777778 "source-unit" "eV" } }