{ "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" [ [ 0.999285 0.250455 0.99915 ] [ 0.999285 0.749545 0.99915 ] [ 0.499802 0.748961 0.500696 ] [ 0.499802 0.251039 0.500696 ] [ 0.521369 0.5 0.219383 ] [ 0.477676 0 0.780281 ] [ 0.022793 0 0.282233 ] [ 0.974999 0.5 0.721351 ] [ 0.919325 0 0.593982 ] [ 0.585481 0 0.092732 ] [ 0.411951 0.5 0.904109 ] [ 0.084649 0.5 0.409284 ] [ 0.789458 0 0.458041 ] [ 0.790711 0.203816 0.66446 ] [ 0.790711 0.796184 0.66446 ] [ 0.762545 0.5 0.404086 ] [ 0.734304 0.5 0.900874 ] [ 0.718388 0.201803 0.162663 ] [ 0.718388 0.798197 0.162663 ] [ 0.708583 0 0.95629 ] [ 0.291843 0.5 0.041441 ] [ 0.275966 0.700541 0.834007 ] [ 0.275966 0.299459 0.834007 ] [ 0.263478 0 0.095489 ] [ 0.240826 0 0.595161 ] [ 0.217886 0.701167 0.338558 ] [ 0.217886 0.298833 0.338558 ] [ 0.206645 0.5 0.546193 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Co" "P" "P" "P" "P" "O" "O" "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" 4.77475882 "source-unit" "angstrom" } "b" { "source-value" 6.11879956 "source-unit" "angstrom" } "c" { "source-value" 10.52859811 "source-unit" "angstrom" } "beta" { "source-value" 90.19942441 "source-unit" "degree" } }