{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmc2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.893353 0 0.731793 ] [ 0.106647 0 0.231793 ] [ 0.393353 0.5 0.731793 ] [ 0.606647 0.5 0.231793 ] [ 0.856892 0.33152 0.767411 ] [ 0.143108 0.33152 0.267411 ] [ 0.856892 0.66848 0.767411 ] [ 0.143108 0.66848 0.267411 ] [ 0.356892 0.83152 0.767411 ] [ 0.643108 0.83152 0.267411 ] [ 0.356892 0.16848 0.767411 ] [ 0.643108 0.16848 0.267411 ] [ 0.0253 0.131368 0.499653 ] [ 0.9747 0.131368 0.999653 ] [ 0.398422 0 0.134078 ] [ 0.601578 0 0.634078 ] [ 0.9747 0.868632 0.999653 ] [ 0.0253 0.868632 0.499653 ] [ 0.5253 0.631368 0.499653 ] [ 0.4747 0.631368 0.999653 ] [ 0.898422 0.5 0.134078 ] [ 0.101578 0.5 0.634078 ] [ 0.4747 0.368632 0.999653 ] [ 0.5253 0.368632 0.499653 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Tb" "K" "K" "K" "K" "K" "K" "K" "K" "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" 7.04133484 "source-unit" "angstrom" } "b" { "source-value" 11.01947234 "source-unit" "angstrom" } "c" { "source-value" 6.18653734 "source-unit" "angstrom" } }