{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.910142 0.544036 0.715685 ] [ 0.089858 0.044036 0.784315 ] [ 0.910142 0.955964 0.215685 ] [ 0.089858 0.455964 0.284315 ] [ 0.361091 0.708489 0.101021 ] [ 0.638909 0.208489 0.398979 ] [ 0.361091 0.791511 0.601021 ] [ 0.638909 0.291511 0.898979 ] [ 0.754201 0.696874 0.71955 ] [ 0.265408 0.610429 0.315301 ] [ 0.966892 0.927666 0.023616 ] [ 0.813765 0.031507 0.607635 ] [ 0.186235 0.531507 0.892365 ] [ 0.033108 0.427666 0.476384 ] [ 0.734592 0.110429 0.184699 ] [ 0.754201 0.803126 0.21955 ] [ 0.245799 0.196874 0.78045 ] [ 0.265408 0.889571 0.815301 ] [ 0.966892 0.572334 0.523616 ] [ 0.813765 0.468493 0.107635 ] [ 0.186235 0.968493 0.392365 ] [ 0.033108 0.072334 0.976384 ] [ 0.734592 0.389571 0.684699 ] [ 0.245799 0.303126 0.28045 ] ] } "species" { "source-value" [ "Cr" "Cr" "Cr" "Cr" "Ag" "Ag" "Ag" "Ag" "O" "O" "O" "O" "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" 5.81207809 "source-unit" "angstrom" } "b" { "source-value" 8.80900543 "source-unit" "angstrom" } "c" { "source-value" 8.61019785 "source-unit" "angstrom" } "beta" { "source-value" 116.64309163 "source-unit" "degree" } }