{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.499587 0.066013 0.999796 ] [ 0.499587 0.933987 0.499796 ] [ 0.629399 0.193602 0.508179 ] [ 0.629399 0.806398 0.008179 ] [ 0.999587 0.566013 0.999796 ] [ 0.999587 0.433987 0.499796 ] [ 0.129399 0.693602 0.508179 ] [ 0.129399 0.306398 0.008179 ] [ 0.41796 0.196299 0.159217 ] [ 0.41796 0.803701 0.659217 ] [ 0.554153 0.065941 0.678907 ] [ 0.554153 0.934059 0.178907 ] [ 0.91796 0.696299 0.159217 ] [ 0.91796 0.303701 0.659217 ] [ 0.054153 0.565941 0.678907 ] [ 0.054153 0.434059 0.178907 ] ] } "species" { "source-value" [ "B" "B" "B" "B" "B" "B" "B" "B" "N" "N" "N" "N" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.28764166336 "source-unit" "angstrom" } "b" { "source-value" 9.43106920071 "source-unit" "angstrom" } "c" { "source-value" 4.34856997212 "source-unit" "angstrom" } "beta" { "source-value" 105.921928681 "source-unit" "degree" } }