{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.788656 0.5 0.6583 ] [ 0 0 0.5 ] [ 0.188594 0.5 0.860757 ] [ 0.811406 0.5 0.139243 ] [ 0.211344 0.5 0.3417 ] [ 0.288656 0 0.6583 ] [ 0.5 0.5 0.5 ] [ 0.688594 0 0.860757 ] [ 0.311406 0 0.139243 ] [ 0.711344 0 0.3417 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.143901 0 0.826243 ] [ 0 0.5 0 ] [ 0.843146 0 0.682925 ] [ 0.156854 0 0.317075 ] [ 0.856099 0 0.173757 ] [ 0.643901 0.5 0.826243 ] [ 0.5 0 0 ] [ 0.343146 0.5 0.682925 ] [ 0.656854 0.5 0.317075 ] [ 0.356099 0.5 0.173757 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Sb" "Sb" "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" 9.82783488195 "source-unit" "angstrom" } "b" { "source-value" 4.06788413 "source-unit" "angstrom" } "c" { "source-value" 5.87935754548 "source-unit" "angstrom" } "beta" { "source-value" 108.883830003 "source-unit" "degree" } }