{ "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" [ [ 0.233021 0.107855 0.451929 ] [ 0.766979 0.892145 0.548071 ] [ 0 0 0 ] [ 0.080064 0.384261 0.812091 ] [ 0.664247 0.574279 0.710308 ] [ 0.335753 0.425721 0.289692 ] [ 0.919936 0.615739 0.187909 ] [ 0.494435 0.223238 0.85615 ] [ 0.795552 0.209334 0.396785 ] [ 0.204448 0.790666 0.603215 ] [ 0.505565 0.776762 0.14385 ] [ 0.884877 0.170263 0.569816 ] [ 0.781475 0.34754 0.95404 ] [ 0.5369 0.017379 0.276078 ] [ 0.408151 0.324726 0.726493 ] [ 0.027173 0.187163 0.271115 ] [ 0.707867 0.408493 0.444687 ] [ 0.306655 0.229123 0.011408 ] [ 0.693345 0.770877 0.988592 ] [ 0.292133 0.591507 0.555313 ] [ 0.972827 0.812837 0.728885 ] [ 0.591849 0.675274 0.273508 ] [ 0.4631 0.982621 0.723922 ] [ 0.218525 0.65246 0.04596 ] [ 0.115123 0.829737 0.430184 ] ] } "species" { "source-value" [ "Li" "Li" "Cr" "Cr" "Cr" "Cr" "Cr" "Si" "Si" "Si" "Si" "O" "O" "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" 5.63854558 "source-unit" "angstrom" } "b" { "source-value" 7.61409183 "source-unit" "angstrom" } "c" { "source-value" 8.04789766 "source-unit" "angstrom" } "alpha" { "source-value" 113.88217606 "source-unit" "degree" } "beta" { "source-value" 90.96636053 "source-unit" "degree" } "gamma" { "source-value" 105.72297427 "source-unit" "degree" } }