{ "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" [ [ 0.734804 0.554556 0.252169 ] [ 0.265196 0.445444 0.747831 ] [ 0.088619 0.900421 0.17571 ] [ 0.911381 0.099579 0.82429 ] [ 0.835738 0.578681 0.793162 ] [ 0.164262 0.421319 0.206838 ] [ 0.32331 0.969299 0.710799 ] [ 0.67669 0.030701 0.289201 ] [ 0.812368 0.86795 0.219457 ] [ 0.187632 0.13205 0.780543 ] [ 0.925862 0.848851 0.892671 ] [ 0.074138 0.151149 0.107329 ] [ 0.589048 0.486784 0.830799 ] [ 0.410952 0.513216 0.169201 ] [ 0.24277 0.42129 0.458772 ] [ 0.75723 0.57871 0.541228 ] [ 0.758373 0.040727 0.550516 ] [ 0.241627 0.959273 0.449484 ] [ 0.773998 0.271467 0.239303 ] [ 0.226002 0.728533 0.760697 ] [ 0.021409 0.62425 0.151129 ] [ 0.978591 0.37575 0.848871 ] [ 0.378332 0.943237 0.164672 ] [ 0.621668 0.056763 0.835328 ] ] } "species" { "source-value" [ "Li" "Li" "Al" "Al" "Mo" "Mo" "Mo" "Mo" "O" "O" "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" 6.72594906476 "source-unit" "angstrom" } "b" { "source-value" 7.13332692927 "source-unit" "angstrom" } "c" { "source-value" 7.36219545214 "source-unit" "angstrom" } "alpha" { "source-value" 90.9824751819 "source-unit" "degree" } "beta" { "source-value" 110.856269698 "source-unit" "degree" } "gamma" { "source-value" 105.003364299 "source-unit" "degree" } }