{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.737167 0.402903 0.819087 ] [ 0.262833 0.597097 0.180913 ] [ 0 0 0.5 ] [ 0 0 0 ] [ 0.675766 0.376151 0.229303 ] [ 0.324234 0.623849 0.770697 ] [ 0.387732 0.0482 0.328346 ] [ 0.612268 0.9518 0.671654 ] [ 0.795183 0.069424 0.723285 ] [ 0.710013 0.214389 0.3562 ] [ 0.328098 0.358487 0.662535 ] [ 0.390595 0.275914 0.068361 ] [ 0.903123 0.377416 0.141259 ] [ 0.096877 0.622584 0.858741 ] [ 0.609405 0.724086 0.931639 ] [ 0.671902 0.641513 0.337465 ] [ 0.289987 0.785611 0.6438 ] [ 0.204817 0.930576 0.276715 ] ] } "species" { "source-value" [ "Li" "Li" "Sb" "Sb" "P" "P" "H" "H" "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" 5.30083821 "source-unit" "angstrom" } "b" { "source-value" 5.84247364 "source-unit" "angstrom" } "c" { "source-value" 7.95753857 "source-unit" "angstrom" } "alpha" { "source-value" 106.05173056 "source-unit" "degree" } "beta" { "source-value" 107.51360683 "source-unit" "degree" } "gamma" { "source-value" 97.68609281 "source-unit" "degree" } }