{ "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" [ [ 0.465314 0.174663 0.058511 ] [ 0.464296 0.168547 0.453959 ] [ 0.464296 0.831453 0.953959 ] [ 0.465314 0.825337 0.558511 ] [ 0.965314 0.674663 0.058511 ] [ 0.964296 0.668547 0.453959 ] [ 0.964296 0.331453 0.953959 ] [ 0.965314 0.325337 0.558511 ] [ 0.002082 0.029619 0.256506 ] [ 0.002082 0.970381 0.756506 ] [ 0.502082 0.529619 0.256506 ] [ 0.502082 0.470381 0.756506 ] [ 0.327947 0.003577 0.000953 ] [ 0.811637 0.819404 0.947451 ] [ 0.811637 0.180596 0.447451 ] [ 0.327947 0.996423 0.500953 ] [ 0.810906 0.812453 0.564664 ] [ 0.326818 0.190045 0.256527 ] [ 0.326818 0.809955 0.756527 ] [ 0.810906 0.187547 0.064664 ] [ 0.827947 0.503577 0.000953 ] [ 0.311637 0.319404 0.947451 ] [ 0.311637 0.680596 0.447451 ] [ 0.827947 0.496423 0.500953 ] [ 0.310906 0.312453 0.564664 ] [ 0.826818 0.690045 0.256527 ] [ 0.826818 0.309955 0.756527 ] [ 0.310906 0.687547 0.064664 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Pb" "Pb" "Pb" "Pb" "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" 5.33816099682 "source-unit" "angstrom" } "b" { "source-value" 9.50907812938 "source-unit" "angstrom" } "c" { "source-value" 8.72008104208 "source-unit" "angstrom" } "beta" { "source-value" 90.0289151769 "source-unit" "degree" } }