{ "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" [ [ 0.478124 0.501101 0.25 ] [ 0.978124 0.998899 0.75 ] [ 0.521876 0.498899 0.75 ] [ 0.021876 0.001101 0.25 ] [ 0.638671 0.320659 0.929299 ] [ 0.678832 0.077434 0.25 ] [ 0.138671 0.179341 0.070701 ] [ 0.138671 0.179341 0.429299 ] [ 0.178832 0.422566 0.75 ] [ 0.321168 0.922566 0.75 ] [ 0.361329 0.679341 0.070701 ] [ 0.861329 0.820659 0.929299 ] [ 0.361329 0.679341 0.429299 ] [ 0.861329 0.820659 0.570701 ] [ 0.638671 0.320659 0.570701 ] [ 0.821168 0.577434 0.25 ] ] } "species" { "source-value" [ "Sb" "Sb" "Sb" "Sb" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.17013784 "source-unit" "angstrom" } "b" { "source-value" 8.74564778 "source-unit" "angstrom" } "c" { "source-value" 10.34172007 "source-unit" "angstrom" } }