{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmn" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0.123762 ] [ 0 0.5 0.876238 ] [ 0.5 0 0.625192 ] [ 0 0.5 0.374808 ] [ 0 0 0.41803 ] [ 0.5 0.5 0.58197 ] [ 0 0 0.829123 ] [ 0.5 0.5 0.170877 ] ] } "species" { "source-value" [ "Na" "Na" "Mn" "Mn" "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" 2.92181425 "source-unit" "angstrom" } "b" { "source-value" 4.85469826 "source-unit" "angstrom" } "c" { "source-value" 6.40939065 "source-unit" "angstrom" } }