{ "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" [ [ 0.358773 0.873584 0.972098 ] [ 0.358773 0.126416 0.472098 ] [ 0.143935 0.376767 0.534123 ] [ 0.143935 0.623233 0.034123 ] [ 0.858773 0.373584 0.972098 ] [ 0.858773 0.626416 0.472098 ] [ 0.643935 0.876767 0.534123 ] [ 0.643935 0.123233 0.034123 ] [ 0.494672 0.498218 0.496972 ] [ 0.253169 0.251318 0.003068 ] [ 0.753169 0.248682 0.503068 ] [ 0.994672 0.001782 0.996972 ] [ 0.994672 0.998218 0.496972 ] [ 0.753169 0.751318 0.003068 ] [ 0.253169 0.748682 0.503068 ] [ 0.494672 0.501782 0.996972 ] [ 0.001613 0.396748 0.753431 ] [ 0.501638 0.351526 0.754267 ] [ 0.501613 0.103252 0.253431 ] [ 0.001638 0.148474 0.254267 ] [ 0.501613 0.896748 0.753431 ] [ 0.001638 0.851526 0.754267 ] [ 0.001613 0.603252 0.253431 ] [ 0.501638 0.648474 0.254267 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "S" "S" "S" "S" "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" 8.57375708 "source-unit" "angstrom" } "b" { "source-value" 8.60796248 "source-unit" "angstrom" } "c" { "source-value" 6.96750604 "source-unit" "angstrom" } "beta" { "source-value" 127.80044448 "source-unit" "degree" } }