{ "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 0.432997 0.729342 ] [ 0.75 0.567003 0.270658 ] [ 0.75 0.932997 0.770658 ] [ 0.25 0.067003 0.229342 ] [ 0.25 0.804226 0.509365 ] [ 0.75 0.195774 0.490635 ] [ 0.75 0.304226 0.990635 ] [ 0.25 0.695774 0.009365 ] ] } "species" { "source-value" [ "Np" "Np" "Np" "Np" "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" 2.57272811 "source-unit" "angstrom" } "b" { "source-value" 5.47006032 "source-unit" "angstrom" } "c" { "source-value" 9.5390705 "source-unit" "angstrom" } }