{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmn" } "basis-atom-coordinates" { "source-value" [ [ 0.242146 0.731608 0.702019 ] [ 0.242146 0.268392 0.702019 ] [ 0.779589 0 0.5 ] [ 0.242146 0.731608 0.297981 ] [ 0.242146 0.268392 0.297981 ] [ 0.757854 0.768392 0.202019 ] [ 0.757854 0.231608 0.202019 ] [ 0.220411 0.5 0 ] [ 0.757854 0.768392 0.797981 ] [ 0.757854 0.231608 0.797981 ] [ 0.822818 0.5 0.5 ] [ 0.177182 0 0 ] [ 0.975508 0.5 0.783609 ] [ 0.530378 0.740054 0.5 ] [ 0.530378 0.259946 0.5 ] [ 0.975508 0.5 0.216391 ] [ 0.024492 0 0.283609 ] [ 0.469622 0.759946 0 ] [ 0.469622 0.240054 0 ] [ 0.024492 0 0.716391 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Sb" "Sb" "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" 5.63571569 "source-unit" "angstrom" } "b" { "source-value" 7.73280989 "source-unit" "angstrom" } "c" { "source-value" 9.29063842 "source-unit" "angstrom" } }