{ "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" [ [ 0.761699 0.5 0.902368 ] [ 0.248653 0.272949 0.725847 ] [ 0.248653 0.727051 0.725847 ] [ 0.75026 0.773382 0.275012 ] [ 0.75026 0.226618 0.275012 ] [ 0.237619 0 0.093864 ] [ 0.214323 0.5 0.335752 ] [ 0.790101 0 0.668556 ] [ 0.719756 0.5 0.58931 ] [ 0.282101 0 0.414467 ] [ 0.703443 0 0.963539 ] [ 0.294545 0.5 0.032016 ] [ 0.948693 0 0.927224 ] [ 0.362097 0.5 0.888453 ] [ 0.514414 0 0.849095 ] [ 0.828679 0.31181 0.689676 ] [ 0.828679 0.68819 0.689676 ] [ 0.177593 0 0.580044 ] [ 0.408935 0.5 0.579634 ] [ 0.594458 0 0.432239 ] [ 0.813593 0.5 0.421407 ] [ 0.175304 0.185834 0.311402 ] [ 0.175304 0.814166 0.311402 ] [ 0.482793 0.5 0.146774 ] [ 0.641035 0 0.108233 ] [ 0.047008 0.5 0.063151 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Cr" "Co" "P" "P" "C" "C" "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" 5.00789098 "source-unit" "angstrom" } "b" { "source-value" 6.46127041 "source-unit" "angstrom" } "c" { "source-value" 8.55661077 "source-unit" "angstrom" } "beta" { "source-value" 94.41831841 "source-unit" "degree" } }