{ "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" [ [ 0.511709 0.775406 0.398142 ] [ 0 0.5 0.5 ] [ 0.488291 0.224594 0.601858 ] [ 0.026594 0.874956 0.688381 ] [ 0.973406 0.125044 0.311619 ] [ 0.5 0 0 ] [ 0.985496 0.309891 0.892903 ] [ 0.014504 0.690109 0.107097 ] [ 0.243824 0.974465 0.848992 ] [ 0.783904 0.88007 0.528451 ] [ 0.797206 0.679753 0.935401 ] [ 0.245273 0.794746 0.225479 ] [ 0.216627 0.553942 0.659416 ] [ 0.783373 0.446058 0.340584 ] [ 0.754727 0.205254 0.774521 ] [ 0.202794 0.320247 0.064599 ] [ 0.216096 0.11993 0.471549 ] [ 0.756176 0.025535 0.151008 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Ti" "Ti" "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" 5.02551232 "source-unit" "angstrom" } "b" { "source-value" 5.23650092 "source-unit" "angstrom" } "c" { "source-value" 7.71184984 "source-unit" "angstrom" } "alpha" { "source-value" 73.87612891 "source-unit" "degree" } "beta" { "source-value" 74.70369153 "source-unit" "degree" } "gamma" { "source-value" 81.17194369 "source-unit" "degree" } }