{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.241215 0.75 ] [ 0 0.758785 0.25 ] [ 0.5 0.741215 0.75 ] [ 0.5 0.258785 0.25 ] [ 0.5 0.098186 0.75 ] [ 0.5 0.901814 0.25 ] [ 0 0.156593 0.43112 ] [ 0 0.843407 0.56888 ] [ 0 0.843407 0.93112 ] [ 0 0.156593 0.06888 ] [ 0 0.598186 0.75 ] [ 0 0.401814 0.25 ] [ 0.5 0.656593 0.43112 ] [ 0.5 0.343407 0.56888 ] [ 0.5 0.343407 0.93112 ] [ 0.5 0.656593 0.06888 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.79723029 "source-unit" "angstrom" } "b" { "source-value" 12.99074436 "source-unit" "angstrom" } "c" { "source-value" 8.56869929 "source-unit" "angstrom" } }