{ "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" [ [ 0.204178 0.89785 0.391709 ] [ 0.402471 0.296483 0.795262 ] [ 0.5 0.5 0.5 ] [ 0.597529 0.703517 0.204738 ] [ 0.795822 0.10215 0.608291 ] [ 0.106803 0.675186 0.694341 ] [ 0.893197 0.324814 0.305659 ] [ 0 0.5 0 ] [ 0.699153 0.890217 0.900939 ] [ 0.300847 0.109783 0.099061 ] [ 0.058527 0.027162 0.839728 ] [ 0.353884 0.674298 0.935809 ] [ 0.134521 0.336178 0.551783 ] [ 0.212539 0.51679 0.244081 ] [ 0.451586 0.884175 0.667043 ] [ 0.548414 0.115825 0.332957 ] [ 0.787461 0.48321 0.755919 ] [ 0.865479 0.663822 0.448217 ] [ 0.646116 0.325702 0.064191 ] [ 0.941473 0.972838 0.160272 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Cr" "Cr" "Cu" "Cu" "Cu" "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" 5.0372382 "source-unit" "angstrom" } "b" { "source-value" 5.40497439 "source-unit" "angstrom" } "c" { "source-value" 7.62357958 "source-unit" "angstrom" } "alpha" { "source-value" 104.2755821 "source-unit" "degree" } "beta" { "source-value" 102.84222165 "source-unit" "degree" } "gamma" { "source-value" 105.04884397 "source-unit" "degree" } }