{ "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" [ [ 0.316902 0.495566 0.157559 ] [ 0.816902 0.004434 0.657559 ] [ 0.683098 0.504434 0.842441 ] [ 0.183098 0.995566 0.342441 ] [ 0.519445 0.614994 0.500968 ] [ 0.019445 0.885006 0.000968 ] [ 0.480555 0.385006 0.499032 ] [ 0.980555 0.114994 0.999032 ] [ 0.080341 0.802465 0.885918 ] [ 0.919659 0.197535 0.114082 ] [ 0.489546 0.699914 0.61828 ] [ 0.580341 0.697535 0.385918 ] [ 0.989546 0.800086 0.11828 ] [ 0.419659 0.302465 0.614082 ] [ 0.010454 0.199914 0.88172 ] [ 0.510454 0.300086 0.38172 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "C" "C" "C" "C" "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" 3.26131569206 "source-unit" "angstrom" } "b" { "source-value" 6.81233446 "source-unit" "angstrom" } "c" { "source-value" 9.46317202698 "source-unit" "angstrom" } "beta" { "source-value" 98.8505537258 "source-unit" "degree" } }