{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0 0.209207 0.25 ] [ 0 0.790793 0.75 ] [ 0 0.913885 0.602733 ] [ 0 0.086115 0.397267 ] [ 0 0.086115 0.102733 ] [ 0 0.913885 0.897267 ] [ 0.5 0.709207 0.25 ] [ 0.5 0.290793 0.75 ] [ 0.5 0.413885 0.602733 ] [ 0.5 0.586115 0.397267 ] [ 0.5 0.586115 0.102733 ] [ 0.5 0.413885 0.897267 ] [ 0.5 0.002285 0.25 ] [ 0.5 0.997715 0.75 ] [ 0 0.211418 0.606919 ] [ 0 0.788582 0.393081 ] [ 0 0.788582 0.106919 ] [ 0 0.211418 0.893081 ] [ 0 0.502285 0.25 ] [ 0 0.497715 0.75 ] [ 0.5 0.711418 0.606919 ] [ 0.5 0.288582 0.393081 ] [ 0.5 0.288582 0.106919 ] [ 0.5 0.711418 0.893081 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "W" "W" "W" "W" "W" "W" "W" "W" "W" "W" "W" "W" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.18731272 "source-unit" "angstrom" } "b" { "source-value" 8.47992424 "source-unit" "angstrom" } "c" { "source-value" 10.80454431 "source-unit" "angstrom" } }