{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.167006 0 ] [ 0 0.167006 0.5 ] [ 0 0.832994 0 ] [ 0 0.832994 0.5 ] [ 0.5 0.667006 0 ] [ 0.5 0.667006 0.5 ] [ 0.5 0.332994 0 ] [ 0.5 0.332994 0.5 ] [ 0.4679 0 0.75 ] [ 0.5321 0 0.25 ] [ 0.9679 0.5 0.75 ] [ 0.0321 0.5 0.25 ] [ 0.808402 0.290577 0.25 ] [ 0.058398 0 0.75 ] [ 0.191598 0.290577 0.75 ] [ 0.808402 0.709423 0.25 ] [ 0.941602 0 0.25 ] [ 0.191598 0.709423 0.75 ] [ 0.308402 0.790577 0.25 ] [ 0.558398 0.5 0.75 ] [ 0.691598 0.790577 0.75 ] [ 0.308402 0.209423 0.25 ] [ 0.441602 0.5 0.25 ] [ 0.691598 0.209423 0.75 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Ag" "Ag" "Ag" "Ag" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.5079684 "source-unit" "angstrom" } "b" { "source-value" 9.20161557 "source-unit" "angstrom" } "c" { "source-value" 5.39358042 "source-unit" "angstrom" } }