{ "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" [ [ 0.160841 0.639688 0.337329 ] [ 0.337285 0.138701 0.163241 ] [ 0.660049 0.638861 0.837372 ] [ 0.838879 0.13751 0.662166 ] [ 0.150066 0.000711 0.365773 ] [ 0.35096 0.501328 0.135912 ] [ 0.648496 0.00009 0.864272 ] [ 0.850992 0.499498 0.636387 ] [ 0.139005 0.81959 0.738261 ] [ 0.171136 0.216721 0.95679 ] [ 0.332045 0.712556 0.543299 ] [ 0.360749 0.319039 0.761124 ] [ 0.640542 0.822799 0.239313 ] [ 0.669583 0.215763 0.455735 ] [ 0.830417 0.715879 0.043242 ] [ 0.861078 0.319917 0.258944 ] [ 0.001314 0.158201 0.247316 ] [ 0.053357 0.464122 0.241322 ] [ 0.094132 0.321631 0.697744 ] [ 0.143433 0.56313 0.543476 ] [ 0.123876 0.675324 0.07434 ] [ 0.220272 0.845926 0.623367 ] [ 0.191172 0.304585 0.056856 ] [ 0.282397 0.347158 0.876547 ] [ 0.317276 0.795513 0.442832 ] [ 0.355776 0.066989 0.957608 ] [ 0.369625 0.175468 0.427725 ] [ 0.404886 0.822345 0.802416 ] [ 0.448185 0.964619 0.259415 ] [ 0.504267 0.155936 0.75275 ] [ 0.496359 0.65907 0.246881 ] [ 0.554881 0.460778 0.741371 ] [ 0.590833 0.325846 0.197416 ] [ 0.624608 0.673411 0.577185 ] [ 0.642353 0.566538 0.042071 ] [ 0.687847 0.304475 0.556165 ] [ 0.721533 0.848056 0.123998 ] [ 0.809933 0.802623 0.943152 ] [ 0.781684 0.34445 0.375423 ] [ 0.87645 0.176031 0.925384 ] [ 0.854091 0.066098 0.458381 ] [ 0.906898 0.824397 0.304155 ] [ 0.94581 0.961097 0.758751 ] [ 0.994627 0.656374 0.746791 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "V" "V" "V" "P" "P" "P" "P" "P" "P" "P" "P" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 4.87726023 "source-unit" "angstrom" } "b" { "source-value" 8.29197624 "source-unit" "angstrom" } "c" { "source-value" 13.36768972 "source-unit" "angstrom" } "alpha" { "source-value" 90.48543222 "source-unit" "degree" } "beta" { "source-value" 91.41418977 "source-unit" "degree" } "gamma" { "source-value" 90.34707192 "source-unit" "degree" } }