{ "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" [ [ 0.98077 0.206877 0.154275 ] [ 0.51923 0.706877 0.345725 ] [ 0.01923 0.793123 0.845725 ] [ 0.48077 0.293123 0.654275 ] [ 0.469036 0.750054 0.074998 ] [ 0.030964 0.250054 0.425002 ] [ 0.530964 0.249946 0.925002 ] [ 0.969036 0.749946 0.574998 ] [ 0.29369 0.050073 0.022405 ] [ 0.20631 0.550073 0.477595 ] [ 0.70631 0.949927 0.977595 ] [ 0.79369 0.449927 0.522405 ] [ 0.669614 0.439208 0.058901 ] [ 0.830386 0.939208 0.441099 ] [ 0.330386 0.560792 0.941099 ] [ 0.169614 0.060792 0.558901 ] [ 0.244527 0.618411 0.151919 ] [ 0.255473 0.118411 0.348081 ] [ 0.755473 0.381589 0.848081 ] [ 0.744527 0.881589 0.651919 ] [ 0.654645 0.886203 0.184137 ] [ 0.845355 0.386203 0.315863 ] [ 0.345355 0.113797 0.815863 ] [ 0.154645 0.613797 0.684137 ] ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" "W" "W" "W" "W" "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" 5.68693192457 "source-unit" "angstrom" } "b" { "source-value" 5.1079754 "source-unit" "angstrom" } "c" { "source-value" 13.1986840362 "source-unit" "angstrom" } "beta" { "source-value" 94.527250463 "source-unit" "degree" } }