{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.413672 0.675091 0.050944 ] [ 0.947109 0.35473 0.72739 ] [ 0.052891 0.64527 0.27261 ] [ 0.586328 0.324909 0.949056 ] [ 0.635108 0.971811 0.767327 ] [ 0.364892 0.028189 0.232673 ] [ 0.864878 0.682089 0.94328 ] [ 0.135122 0.317911 0.05672 ] [ 0.960221 0.707596 0.584437 ] [ 0.039779 0.292404 0.415563 ] [ 0.543063 0.413038 0.347819 ] [ 0.27579 0.042529 0.532891 ] [ 0.456937 0.586962 0.652181 ] [ 0.820819 0.023673 0.113773 ] [ 0.179181 0.976327 0.886227 ] [ 0.72421 0.957471 0.467109 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Fe" "Fe" "Fe" "Fe" "Fe" "Fe" "Si" "Si" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.60426620804 "source-unit" "angstrom" } "b" { "source-value" 6.32770275802 "source-unit" "angstrom" } "c" { "source-value" 7.46118428919 "source-unit" "angstrom" } "alpha" { "source-value" 101.899929943 "source-unit" "degree" } "beta" { "source-value" 106.777676997 "source-unit" "degree" } "gamma" { "source-value" 100.608165785 "source-unit" "degree" } }