{ "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 0.585981 0.5 ] [ 0.585981 0 0.5 ] [ 0.414019 0.414019 0.5 ] [ 0 0.254253 0 ] [ 0.745747 0.745747 0 ] [ 0.254253 0 0 ] [ 0.333333 0.666667 0 ] [ 0 0 0.5 ] [ 0.666667 0.333333 0 ] ] } "species" { "source-value" [ "Np" "Np" "Np" "Sn" "Sn" "Sn" "Ir" "Ir" "Ir" ] } "a" { "source-value" 7.40061255977 "source-unit" "angstrom" } "c" { "source-value" 4.0420211 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 8.990825724444443 "source-unit" "eV" } }