{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P31m" } "basis-atom-coordinates" { "source-value" [ [ 0.500865 0 0.521456 ] [ 0 0 0.273776 ] [ 0.499135 0.499135 0.521456 ] [ 0 0.500865 0.521456 ] [ 0 0 0.737707 ] [ 0.333333 0.666667 0.020341 ] [ 0.666667 0.333333 0.020341 ] [ 0 0.621832 0.212743 ] [ 0.376115 0 0.829079 ] [ 0.621832 0 0.212743 ] [ 0.378168 0.378168 0.212743 ] [ 0 0.376115 0.829079 ] [ 0.623885 0.623885 0.829079 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Ag" "Pb" "Pb" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 6.06589667644 "source-unit" "angstrom" } "c" { "source-value" 6.52927896 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.432351225384616 "source-unit" "eV" } }