{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcn" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.807281 0.474069 ] [ 0.75 0.192719 0.525931 ] [ 0.75 0.307281 0.025931 ] [ 0.25 0.692719 0.974069 ] [ 0.75 0.578184 0.32039 ] [ 0.75 0.921816 0.82039 ] [ 0.25 0.078184 0.17961 ] [ 0.25 0.421816 0.67961 ] [ 0.75 0.596283 0.683196 ] [ 0.75 0.903717 0.183196 ] [ 0.25 0.096283 0.816804 ] [ 0.25 0.403717 0.316804 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Ni" "Ni" "Ni" "Ni" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.65122575 "source-unit" "angstrom" } "b" { "source-value" 7.49757809 "source-unit" "angstrom" } "c" { "source-value" 7.62014277 "source-unit" "angstrom" } }