{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnnb" } "basis-atom-coordinates" { "source-value" [ [ 0 0.75 0.305781 ] [ 0.5 0.75 0.194219 ] [ 0 0.25 0.694219 ] [ 0.5 0.25 0.805781 ] [ 0 0.75 0.905335 ] [ 0.5 0.25 0.405335 ] [ 0 0.25 0.094665 ] [ 0.5 0.75 0.594665 ] [ 0.704965 0.57559 0.418274 ] [ 0.795035 0.57559 0.081726 ] [ 0.295035 0.92441 0.418274 ] [ 0.25 0.409153 0.25 ] [ 0.75 0.590847 0.75 ] [ 0.25 0.909153 0.75 ] [ 0.795035 0.07559 0.918274 ] [ 0.75 0.090847 0.25 ] [ 0.204965 0.42441 0.918274 ] [ 0.295035 0.42441 0.581726 ] [ 0.704965 0.07559 0.581726 ] [ 0.204965 0.92441 0.081726 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Sb" "Sb" "Sb" "Sb" "O" "O" "O" "O" "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" 4.99198806 "source-unit" "angstrom" } "b" { "source-value" 5.27028174 "source-unit" "angstrom" } "c" { "source-value" 8.60878747 "source-unit" "angstrom" } }