{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-cubic-crystal" "instance-id" 1 "space-group" { "source-value" "Im-3m" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0 0.5 ] [ 0 0.25 0.5 ] [ 0.5 0.25 0 ] [ 0 0.5 0.25 ] [ 0.5 0 0.25 ] [ 0.25 0.5 0 ] [ 0.167317 0.167317 0.167317 ] [ 0.832683 0.167317 0.167317 ] [ 0.167317 0.832683 0.167317 ] [ 0.167317 0.167317 0.832683 ] [ 0.832683 0.167317 0.832683 ] [ 0.832683 0.832683 0.167317 ] [ 0.167317 0.832683 0.832683 ] [ 0.832683 0.832683 0.832683 ] [ 0.75 0.5 0 ] [ 0.5 0.75 0 ] [ 0 0.75 0.5 ] [ 0.5 0 0.75 ] [ 0 0.5 0.75 ] [ 0.75 0 0.5 ] [ 0.667317 0.667317 0.667317 ] [ 0.332683 0.667317 0.667317 ] [ 0.667317 0.332683 0.667317 ] [ 0.667317 0.667317 0.332683 ] [ 0.332683 0.667317 0.332683 ] [ 0.332683 0.332683 0.667317 ] [ 0.667317 0.332683 0.332683 ] [ 0.332683 0.332683 0.332683 ] [ 0.339748 0 0 ] [ 0 0.339748 0 ] [ 0 0.660252 0 ] [ 0 0 0.660252 ] [ 0 0 0.339748 ] [ 0.660252 0 0 ] [ 0.839748 0.5 0.5 ] [ 0.5 0.839748 0.5 ] [ 0.5 0.160252 0.5 ] [ 0.5 0.5 0.160252 ] [ 0.5 0.5 0.839748 ] [ 0.160252 0.5 0.5 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" ] } "short-name" { "source-value" [ "bcc" ] } "a" { "source-value" 8.79775886418 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.1592517739999995 "source-unit" "eV" } }