{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-cubic-crystal" "instance-id" 1 "space-group" { "source-value" "Fm-3c" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0 0.5 ] [ 0.114011 0 0.821726 ] [ 0 0.885989 0.321726 ] [ 0 0.114011 0.321726 ] [ 0.678274 0 0.114011 ] [ 0.321726 0 0.885989 ] [ 0.114011 0.321726 0 ] [ 0.114011 0.678274 0 ] [ 0.178274 0.885989 0 ] [ 0 0.821726 0.885989 ] [ 0 0.821726 0.114011 ] [ 0.821726 0.114011 0 ] [ 0.821726 0.885989 0 ] [ 0 0.178274 0.114011 ] [ 0.178274 0.114011 0 ] [ 0 0.178274 0.885989 ] [ 0.678274 0 0.885989 ] [ 0 0.885989 0.678274 ] [ 0.885989 0.321726 0 ] [ 0.885989 0.678274 0 ] [ 0 0.114011 0.678274 ] [ 0.321726 0 0.114011 ] [ 0.885989 0 0.821726 ] [ 0.885989 0 0.178274 ] [ 0.114011 0 0.178274 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.114011 0.5 0.321726 ] [ 0 0.385989 0.821726 ] [ 0 0.614011 0.821726 ] [ 0.678274 0.5 0.614011 ] [ 0.321726 0.5 0.385989 ] [ 0.114011 0.821726 0.5 ] [ 0.114011 0.178274 0.5 ] [ 0.178274 0.385989 0.5 ] [ 0 0.321726 0.385989 ] [ 0 0.321726 0.614011 ] [ 0.821726 0.614011 0.5 ] [ 0.821726 0.385989 0.5 ] [ 0 0.678274 0.614011 ] [ 0.178274 0.614011 0.5 ] [ 0 0.678274 0.385989 ] [ 0.678274 0.5 0.385989 ] [ 0 0.385989 0.178274 ] [ 0.885989 0.821726 0.5 ] [ 0.885989 0.178274 0.5 ] [ 0 0.614011 0.178274 ] [ 0.321726 0.5 0.614011 ] [ 0.885989 0.5 0.321726 ] [ 0.885989 0.5 0.678274 ] [ 0.114011 0.5 0.678274 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0.614011 0 0.321726 ] [ 0.5 0.885989 0.821726 ] [ 0.5 0.114011 0.821726 ] [ 0.178274 0 0.614011 ] [ 0.821726 0 0.385989 ] [ 0.614011 0.321726 0.5 ] [ 0.614011 0.678274 0.5 ] [ 0.678274 0.885989 0.5 ] [ 0.5 0.821726 0.385989 ] [ 0.5 0.821726 0.614011 ] [ 0.321726 0.114011 0.5 ] [ 0.321726 0.885989 0.5 ] [ 0.5 0.178274 0.614011 ] [ 0.678274 0.114011 0.5 ] [ 0.5 0.178274 0.385989 ] [ 0.178274 0 0.385989 ] [ 0.5 0.885989 0.178274 ] [ 0.385989 0.321726 0.5 ] [ 0.385989 0.678274 0.5 ] [ 0.5 0.114011 0.178274 ] [ 0.821726 0 0.614011 ] [ 0.385989 0 0.321726 ] [ 0.385989 0 0.678274 ] [ 0.614011 0 0.678274 ] [ 0.5 0.5 0 ] [ 0.5 0.5 0.5 ] [ 0.614011 0.5 0.821726 ] [ 0.5 0.385989 0.321726 ] [ 0.5 0.614011 0.321726 ] [ 0.178274 0.5 0.114011 ] [ 0.821726 0.5 0.885989 ] [ 0.614011 0.821726 0 ] [ 0.614011 0.178274 0 ] [ 0.678274 0.385989 0 ] [ 0.5 0.321726 0.885989 ] [ 0.5 0.321726 0.114011 ] [ 0.321726 0.614011 0 ] [ 0.321726 0.385989 0 ] [ 0.5 0.678274 0.114011 ] [ 0.678274 0.614011 0 ] [ 0.5 0.678274 0.885989 ] [ 0.178274 0.5 0.885989 ] [ 0.5 0.385989 0.678274 ] [ 0.385989 0.821726 0 ] [ 0.385989 0.178274 0 ] [ 0.5 0.614011 0.678274 ] [ 0.821726 0.5 0.114011 ] [ 0.385989 0.5 0.821726 ] [ 0.385989 0.5 0.178274 ] [ 0.614011 0.5 0.178274 ] [ 0.25 0.75 0.75 ] [ 0.75 0.25 0.25 ] [ 0.25 0.25 0.25 ] [ 0.75 0.75 0.75 ] [ 0.75 0.75 0.25 ] [ 0.25 0.25 0.75 ] [ 0.75 0.25 0.75 ] [ 0.25 0.75 0.25 ] [ 0.25 0.89314 0.75 ] [ 0.39314 0.75 0.75 ] [ 0.10686 0.75 0.75 ] [ 0.25 0.75 0.60686 ] [ 0.25 0.75 0.89314 ] [ 0.25 0.60686 0.75 ] [ 0.75 0.10686 0.25 ] [ 0.60686 0.25 0.25 ] [ 0.89314 0.25 0.25 ] [ 0.75 0.25 0.39314 ] [ 0.75 0.25 0.10686 ] [ 0.75 0.39314 0.25 ] [ 0.25 0.39314 0.25 ] [ 0.39314 0.25 0.25 ] [ 0.10686 0.25 0.25 ] [ 0.25 0.25 0.10686 ] [ 0.25 0.25 0.39314 ] [ 0.25 0.10686 0.25 ] [ 0.75 0.60686 0.75 ] [ 0.60686 0.75 0.75 ] [ 0.89314 0.75 0.75 ] [ 0.75 0.75 0.89314 ] [ 0.75 0.75 0.60686 ] [ 0.75 0.89314 0.75 ] [ 0.75 0.89314 0.25 ] [ 0.89314 0.75 0.25 ] [ 0.60686 0.75 0.25 ] [ 0.75 0.75 0.10686 ] [ 0.75 0.75 0.39314 ] [ 0.75 0.60686 0.25 ] [ 0.25 0.10686 0.75 ] [ 0.10686 0.25 0.75 ] [ 0.39314 0.25 0.75 ] [ 0.25 0.25 0.89314 ] [ 0.25 0.25 0.60686 ] [ 0.25 0.39314 0.75 ] [ 0.75 0.39314 0.75 ] [ 0.89314 0.25 0.75 ] [ 0.60686 0.25 0.75 ] [ 0.75 0.25 0.60686 ] [ 0.75 0.25 0.89314 ] [ 0.75 0.10686 0.75 ] [ 0.25 0.60686 0.25 ] [ 0.10686 0.75 0.25 ] [ 0.39314 0.75 0.25 ] [ 0.25 0.75 0.39314 ] [ 0.25 0.75 0.10686 ] [ 0.25 0.89314 0.25 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Os" "Os" "Os" "Os" "Os" "Os" "Os" "Os" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 13.4072261982 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.138106589 "source-unit" "eV" } }