{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.289339 0 0.972693 ] [ 0.916643 0 0.827533 ] [ 0.561767 0 0.68898 ] [ 0.207942 0 0.550784 ] [ 0.841443 0 0.407137 ] [ 0.482846 0 0.317944 ] [ 0.297366 0 0.217244 ] [ 0.908313 0 0.159968 ] [ 0.647175 0 0.061786 ] [ 0.789339 0.5 0.972693 ] [ 0.416643 0.5 0.827533 ] [ 0.061767 0.5 0.68898 ] [ 0.707942 0.5 0.550784 ] [ 0.341443 0.5 0.407137 ] [ 0.982846 0.5 0.317944 ] [ 0.797366 0.5 0.217244 ] [ 0.408313 0.5 0.159968 ] [ 0.147175 0.5 0.061786 ] [ 0.181628 0 0.367476 ] [ 0.948997 0 0.011943 ] [ 0.760746 0 0.261502 ] [ 0.365016 0 0.117897 ] [ 0.681628 0.5 0.367476 ] [ 0.448997 0.5 0.011943 ] [ 0.260746 0.5 0.261502 ] [ 0.865016 0.5 0.117897 ] [ 0.583282 0 0.891281 ] [ 0.234416 0 0.756334 ] [ 0.888426 0 0.621333 ] [ 0.540904 0 0.486916 ] [ 0.083282 0.5 0.891281 ] [ 0.734416 0.5 0.756334 ] [ 0.388426 0.5 0.621333 ] [ 0.040904 0.5 0.486916 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "S" "S" "S" "S" "S" "S" "S" "S" "I" "I" "I" "I" "I" "I" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.05279912 "source-unit" "angstrom" } "b" { "source-value" 4.29416437 "source-unit" "angstrom" } "c" { "source-value" 27.12509006 "source-unit" "angstrom" } "beta" { "source-value" 91.1165466 "source-unit" "degree" } }