{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1mn" } "basis-atom-coordinates" { "source-value" [ [ 0.946882 0.079692 0.318156 ] [ 0.946882 0.079692 0.681844 ] [ 0.759965 0.599588 0.691954 ] [ 0.759965 0.599588 0.308046 ] [ 0.725825 0.338867 0 ] [ 0.446882 0.920308 0.818156 ] [ 0.446882 0.920308 0.181844 ] [ 0.259965 0.400412 0.808046 ] [ 0.259965 0.400412 0.191954 ] [ 0.225825 0.661133 0.5 ] [ 0.992028 0.838631 0 ] [ 0.492028 0.161369 0.5 ] [ 0.65321 0.738612 0 ] [ 0.587159 0.81803 0.5 ] [ 0.610062 0.259491 0.264928 ] [ 0.610062 0.259491 0.735072 ] [ 0.15321 0.261388 0.5 ] [ 0.087159 0.18197 0 ] [ 0.110062 0.740509 0.764928 ] [ 0.110062 0.740509 0.235072 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Gd" "Gd" "O" "O" "O" "O" "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" 6.11587585 "source-unit" "angstrom" } "b" { "source-value" 6.13738253 "source-unit" "angstrom" } "c" { "source-value" 8.458487 "source-unit" "angstrom" } }