{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.59671 0.5 ] [ 0.40329 0.40329 0.5 ] [ 0.59671 0 0.5 ] [ 0.253 0 0 ] [ 0.747 0.747 0 ] [ 0 0.253 0 ] [ 0.666667 0.333333 0 ] [ 0.333333 0.666667 0 ] [ 0 0 0.5 ] ] } "species" { "source-value" [ "Hf" "Hf" "Hf" "Mo" "Mo" "Mo" "P" "P" "P" ] } "a" { "source-value" 6.93142208 "source-unit" "angstrom" } "c" { "source-value" 3.41441044 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 9.706434071111111 "source-unit" "eV" } }