{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.002124 0.007639 0.001118 ] [ 0.0015 0.494842 0.167235 ] [ 0.999097 0.001338 0.331902 ] [ 0.997839 0.502101 0.496397 ] [ 0.998585 0.999106 0.667407 ] [ 0.000765 0.494673 0.836256 ] [ 0.499896 0.750142 0.082023 ] [ 0.500027 0.250694 0.583774 ] [ 0.500554 0.749333 0.750707 ] [ 0.499612 0.250755 0.24929 ] [ 0.499646 0.75057 0.414994 ] [ 0.500443 0.248935 0.91872 ] [ 0.728241 0.127823 0.121654 ] [ 0.272389 0.372199 0.045465 ] [ 0.72343 0.620432 0.286094 ] [ 0.276566 0.881373 0.212197 ] [ 0.724223 0.120717 0.453236 ] [ 0.273837 0.383465 0.376921 ] [ 0.726658 0.620398 0.617841 ] [ 0.274597 0.878562 0.545245 ] [ 0.273424 0.377857 0.714031 ] [ 0.727782 0.117962 0.791508 ] [ 0.726943 0.617792 0.955286 ] [ 0.271822 0.881296 0.880699 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "Cr" "Cr" "Cr" "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" 5.15992029 "source-unit" "angstrom" } "b" { "source-value" 5.17925807 "source-unit" "angstrom" } "c" { "source-value" 8.94967411 "source-unit" "angstrom" } "alpha" { "source-value" 90.10136609 "source-unit" "degree" } "beta" { "source-value" 106.68637406 "source-unit" "degree" } "gamma" { "source-value" 99.48896854 "source-unit" "degree" } }