{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/m" } "basis-atom-coordinates" { "source-value" [ [ 0.953906 0.348645 0 ] [ 0.348645 0.046094 0 ] [ 0.651355 0.953906 0 ] [ 0.046094 0.651355 0 ] [ 0 0 0 ] [ 0.453906 0.848645 0.5 ] [ 0.848645 0.546094 0.5 ] [ 0.151355 0.453906 0.5 ] [ 0.546094 0.151355 0.5 ] [ 0.5 0.5 0.5 ] [ 0.177411 0.864989 0.5 ] [ 0.135011 0.177411 0.5 ] [ 0.822589 0.135011 0.5 ] [ 0.864989 0.822589 0.5 ] [ 0.677411 0.364989 0 ] [ 0.635011 0.677411 0 ] [ 0.322589 0.635011 0 ] [ 0.364989 0.322589 0 ] ] } "species" { "source-value" [ "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.4220084228 "source-unit" "angstrom" } "c" { "source-value" 3.39848608411 "source-unit" "angstrom" } }