{ "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 0.38629 0.679648 ] [ 0.75 0.61371 0.320352 ] [ 0.75 0.88629 0.820352 ] [ 0.25 0.11371 0.179648 ] [ 0.25 0.878022 0.535335 ] [ 0.75 0.121978 0.464665 ] [ 0.75 0.378022 0.964665 ] [ 0.25 0.621978 0.035335 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.94504483 "source-unit" "angstrom" } "b" { "source-value" 5.92417753 "source-unit" "angstrom" } "c" { "source-value" 8.26203015 "source-unit" "angstrom" } }