{ "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" [ [ 0.271044 0.491187 0.793587 ] [ 0.728956 0.508813 0.206413 ] [ 0.298238 0.306971 0.442909 ] [ 0.228956 0.991187 0.706413 ] [ 0.771044 0.008813 0.293587 ] [ 0.701762 0.693029 0.557091 ] [ 0.798238 0.193029 0.942909 ] [ 0.201762 0.806971 0.057091 ] [ 0.400847 0.236656 0.140539 ] [ 0.099153 0.736656 0.359461 ] [ 0.599153 0.763344 0.859461 ] [ 0.900847 0.263344 0.640539 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "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" 4.36113618905 "source-unit" "angstrom" } "b" { "source-value" 7.40179517 "source-unit" "angstrom" } "c" { "source-value" 7.78914312194 "source-unit" "angstrom" } "beta" { "source-value" 101.267541064 "source-unit" "degree" } }