{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.010071 0.956427 0.75 ] [ 0.510071 0.543573 0.25 ] [ 0.489929 0.456427 0.75 ] [ 0.989929 0.043573 0.25 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.712903 0.287592 0.458986 ] [ 0.212903 0.212408 0.541014 ] [ 0.787097 0.787592 0.041014 ] [ 0.287097 0.712408 0.958986 ] [ 0.287097 0.712408 0.541014 ] [ 0.787097 0.787592 0.458986 ] [ 0.212903 0.212408 0.958986 ] [ 0.712903 0.287592 0.041014 ] [ 0.077181 0.482594 0.25 ] [ 0.577181 0.017406 0.75 ] [ 0.422819 0.982594 0.25 ] [ 0.922819 0.517406 0.75 ] ] } "species" { "source-value" [ "Gd" "Gd" "Gd" "Gd" "Al" "Al" "Al" "Al" "O" "O" "O" "O" "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" 5.28457078 "source-unit" "angstrom" } "b" { "source-value" 5.37112566 "source-unit" "angstrom" } "c" { "source-value" 7.51058523 "source-unit" "angstrom" } }