{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.170101 0.5 ] [ 0 0.829899 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.670101 0.5 ] [ 0.5 0.329899 0.5 ] [ 0 0.5 0.5 ] [ 0 0.333404 0 ] [ 0 0.666596 0 ] [ 0.5 0.833404 0 ] [ 0.5 0.166596 0 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.235618 0.156911 0.235584 ] [ 0.23527 0 0.771484 ] [ 0.764382 0.843089 0.764416 ] [ 0.235618 0.843089 0.235584 ] [ 0.76473 0 0.228516 ] [ 0.764382 0.156911 0.764416 ] [ 0.735618 0.656911 0.235584 ] [ 0.73527 0.5 0.771484 ] [ 0.264382 0.343089 0.764416 ] [ 0.735618 0.343089 0.235584 ] [ 0.26473 0.5 0.228516 ] [ 0.264382 0.656911 0.764416 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Zn" "Zn" "Zn" "Zn" "Sb" "Sb" "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" 5.31978444863 "source-unit" "angstrom" } "b" { "source-value" 9.17070756083 "source-unit" "angstrom" } "c" { "source-value" 5.27085183012 "source-unit" "angstrom" } "beta" { "source-value" 110.294462438 "source-unit" "degree" } }