{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/nmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.10691 ] [ 0.5 0 0.89309 ] [ 0 0.5 0.727761 ] [ 0.5 0 0.272239 ] [ 0 0.5 0.422291 ] [ 0.5 0 0.577709 ] [ 0 0.5 0.596025 ] [ 0.5 0 0.403975 ] [ 0 0.5 0.932107 ] [ 0.5 0 0.067893 ] [ 0.5 0.5 0.766993 ] [ 0 0 0.766993 ] [ 0.5 0.5 0.233007 ] [ 0 0 0.233007 ] ] } "species" { "source-value" [ "La" "La" "Ti" "Ti" "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" 3.74858214 "source-unit" "angstrom" } "c" { "source-value" 13.60203275 "source-unit" "angstrom" } }