{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.188611 0.112499 0.388942 ] [ 0 0.5 0 ] [ 0.811389 0.887501 0.611058 ] [ 0 0 0 ] [ 0.4304 0.180776 0.796623 ] [ 0.5696 0.819224 0.203377 ] [ 0.798108 0.389397 0.601453 ] [ 0.597976 0.306724 0.198277 ] [ 0.201892 0.610603 0.398547 ] [ 0.402024 0.693276 0.801723 ] [ 0.888611 0.190613 0.806089 ] [ 0.689818 0.088584 0.38196 ] [ 0.108073 0.318566 0.214483 ] [ 0.302861 0.364937 0.616161 ] [ 0.891927 0.681434 0.785517 ] [ 0.5 0.5 0 ] [ 0.697139 0.635063 0.383839 ] [ 0.111389 0.809387 0.193911 ] [ 0.310182 0.911416 0.61804 ] [ 0.5 0 0 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ti" "Ti" "Co" "Co" "Co" "Co" "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" 4.12690511 "source-unit" "angstrom" } "b" { "source-value" 6.02782459 "source-unit" "angstrom" } "c" { "source-value" 7.94737831 "source-unit" "angstrom" } "alpha" { "source-value" 102.98796037 "source-unit" "degree" } "beta" { "source-value" 104.96410564 "source-unit" "degree" } "gamma" { "source-value" 90.1265139 "source-unit" "degree" } }