{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pcnb" } "basis-atom-coordinates" { "source-value" [ [ 0.250086 0.082902 0.879009 ] [ 0.750086 0.917098 0.620991 ] [ 0.249914 0.582902 0.620991 ] [ 0.749914 0.417098 0.879009 ] [ 0.250086 0.582902 0.120991 ] [ 0.750086 0.417098 0.379009 ] [ 0.249914 0.082902 0.379009 ] [ 0.749914 0.917098 0.120991 ] [ 0.5 0.75 0.86619 ] [ 0 0.25 0.63381 ] [ 0.5 0.25 0.13381 ] [ 0 0.75 0.36619 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "Mn" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.39732302 "source-unit" "angstrom" } "b" { "source-value" 4.82691896 "source-unit" "angstrom" } "c" { "source-value" 5.54782889 "source-unit" "angstrom" } }