{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I-42m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0.5 0.75 ] [ 0.5 0.5 0 ] [ 0.5 0 0.75 ] [ 0.5 0 0.25 ] [ 0 0 0.5 ] [ 0 0.5 0.25 ] [ 0.200857 0.200857 0.898331 ] [ 0.200857 0.799143 0.101669 ] [ 0.799143 0.200857 0.101669 ] [ 0.799143 0.799143 0.898331 ] [ 0.700857 0.700857 0.398331 ] [ 0.700857 0.299143 0.601669 ] [ 0.299143 0.700857 0.601669 ] [ 0.299143 0.299143 0.398331 ] ] } "species" { "source-value" [ "V" "V" "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" 5.06708750559 "source-unit" "angstrom" } "c" { "source-value" 9.96840882417 "source-unit" "angstrom" } }