{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.005897 0.03037 0.755675 ] [ 0.005897 0.96963 0.255675 ] [ 0.505897 0.53037 0.755675 ] [ 0.505897 0.46963 0.255675 ] [ 0.035558 0.694229 0.794777 ] [ 0.035558 0.305771 0.294777 ] [ 0.535558 0.194229 0.794777 ] [ 0.535558 0.805771 0.294777 ] [ 0.024767 0.361655 0.789956 ] [ 0.024767 0.638345 0.289956 ] [ 0.524767 0.861655 0.789956 ] [ 0.524767 0.138345 0.289956 ] [ 0.889509 0.881375 0.936556 ] [ 0.889509 0.118625 0.436556 ] [ 0.962665 0.778792 0.474232 ] [ 0.422204 0.984083 0.416404 ] [ 0.422204 0.015917 0.916404 ] [ 0.962665 0.221208 0.974232 ] [ 0.389509 0.381375 0.936556 ] [ 0.389509 0.618625 0.436556 ] [ 0.462665 0.278792 0.474232 ] [ 0.922204 0.484083 0.416404 ] [ 0.922204 0.515917 0.916404 ] [ 0.462665 0.721208 0.974232 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Hg" "Hg" "Hg" "Hg" "As" "As" "As" "As" "S" "S" "S" "S" "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" 6.79104961941 "source-unit" "angstrom" } "b" { "source-value" 11.5217961155 "source-unit" "angstrom" } "c" { "source-value" 7.92357102732 "source-unit" "angstrom" } "beta" { "source-value" 113.147478434 "source-unit" "degree" } }