{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/n" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.25 0.75 ] [ 0.75 0.75 0.25 ] [ 0.568912 0.136774 0.203797 ] [ 0.068912 0.636774 0.796203 ] [ 0.431088 0.863226 0.796203 ] [ 0.636774 0.431088 0.703797 ] [ 0.863226 0.068912 0.703797 ] [ 0.363226 0.568912 0.296203 ] [ 0.931088 0.363226 0.203797 ] [ 0.136774 0.931088 0.296203 ] [ 0.811467 0.577711 0.439295 ] [ 0.422289 0.311467 0.939295 ] [ 0.922289 0.811467 0.060705 ] [ 0.188533 0.422289 0.560705 ] [ 0.077711 0.188533 0.939295 ] [ 0.688533 0.922289 0.439295 ] [ 0.577711 0.688533 0.060705 ] [ 0.311467 0.077711 0.560705 ] ] } "species" { "source-value" [ "Si" "Si" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.46189874 "source-unit" "angstrom" } "c" { "source-value" 4.9677522 "source-unit" "angstrom" } }