{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.840264 0.049904 ] [ 0.25 0.159736 0.950096 ] [ 0.75 0.340264 0.450096 ] [ 0.25 0.659736 0.549904 ] [ 0.75 0.468516 0.83706 ] [ 0.25 0.531484 0.16294 ] [ 0.75 0.968516 0.66294 ] [ 0.25 0.031484 0.33706 ] [ 0.75 0.982129 0.89491 ] [ 0.25 0.017871 0.10509 ] [ 0.75 0.482129 0.60509 ] [ 0.25 0.517871 0.39491 ] [ 0.75 0.331478 0.004987 ] [ 0.25 0.668522 0.995013 ] [ 0.75 0.831478 0.495013 ] [ 0.25 0.168522 0.504987 ] [ 0.75 0.719698 0.207568 ] [ 0.25 0.280302 0.792432 ] [ 0.75 0.219698 0.292432 ] [ 0.25 0.780302 0.707568 ] ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.80154931 "source-unit" "angstrom" } "b" { "source-value" 9.27176787 "source-unit" "angstrom" } "c" { "source-value" 14.43049431 "source-unit" "angstrom" } }