{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.716346 0.5 0.698033 ] [ 0.984151 0.5 0.285253 ] [ 0.301568 0.5 0.016296 ] [ 0.62722 0 0.987847 ] [ 0.359097 0 0.366942 ] [ 0.00761 0 0.640388 ] [ 0.002418 0 0.001815 ] [ 0.666616 0.5 0.335478 ] [ 0.331272 0.5 0.66378 ] [ 0.891225 0 0.807455 ] [ 0.861422 0.5 0.443623 ] [ 0.920015 0 0.113589 ] [ 0.557738 0.5 0.421241 ] [ 0.581021 0.5 0.141796 ] [ 0.525599 0.5 0.77705 ] [ 0.196668 0 0.083854 ] [ 0.217669 0.5 0.744985 ] [ 0.252344 0.5 0.470573 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Mn" "Fe" "Fe" "B" "B" "B" "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" 8.23384942 "source-unit" "angstrom" } "b" { "source-value" 3.15355916 "source-unit" "angstrom" } "c" { "source-value" 8.25074563 "source-unit" "angstrom" } "beta" { "source-value" 119.81889825 "source-unit" "degree" } }