{ "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" [ [ 0.998503 0 0.003041 ] [ 0.247602 0 0.744627 ] [ 0.498503 0.5 0.003041 ] [ 0.747602 0.5 0.744627 ] [ 0.001237 0.5 0.505113 ] [ 0.246832 0.5 0.253915 ] [ 0.501237 0 0.505113 ] [ 0.746832 0 0.253915 ] [ 0.235965 0 0.235147 ] [ 0.760648 0 0.765134 ] [ 0.010213 0 0.51367 ] [ 0.98527 0.5 0.988032 ] [ 0.735965 0.5 0.235147 ] [ 0.260648 0.5 0.765134 ] [ 0.510213 0.5 0.51367 ] [ 0.48527 0 0.988032 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "Ag" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 13.3582695 "source-unit" "angstrom" } "b" { "source-value" 5.72809744 "source-unit" "angstrom" } "c" { "source-value" 5.7283432 "source-unit" "angstrom" } "beta" { "source-value" 115.06957482 "source-unit" "degree" } }