{ "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" [ [ 0.975134 0.018144 0.014457 ] [ 0.253421 0.631232 0.844765 ] [ 0.521018 0.483259 0.481441 ] [ 0.769269 0.323757 0.147977 ] [ 0.315526 0.14531 0.771552 ] [ 0.149313 0.770045 0.318696 ] [ 0.15242 0.154364 0.152502 ] [ 0.853798 0.856739 0.851903 ] [ 0.64261 0.645791 0.637253 ] [ 0.334207 0.334672 0.335433 ] [ 0.926596 0.579407 0.253874 ] [ 0.579384 0.254821 0.929115 ] [ 0.252707 0.933624 0.57292 ] [ 0.757422 0.042858 0.446539 ] [ 0.442396 0.756079 0.036294 ] [ 0.046017 0.451047 0.758403 ] [ 0.880056 0.507234 0.697462 ] [ 0.682304 0.891612 0.484864 ] [ 0.906267 0.75882 0.092386 ] [ 0.458906 0.68787 0.886916 ] [ 0.737018 0.584042 0.400585 ] [ 0.984162 0.412311 0.197819 ] [ 0.75971 0.098281 0.898128 ] [ 0.574238 0.409065 0.74323 ] [ 0.396066 0.738923 0.586802 ] [ 0.827971 0.994904 0.602656 ] [ 0.915128 0.05067 0.266615 ] [ 0.614833 0.806531 0.977284 ] [ 0.409161 0.20275 0.986772 ] [ 0.101455 0.897469 0.75906 ] [ 0.199018 0.987002 0.406878 ] [ 0.615106 0.232502 0.42278 ] [ 0.420106 0.615068 0.225577 ] [ 0.27013 0.922146 0.045505 ] [ 0.029101 0.606803 0.81679 ] [ 0.230756 0.416745 0.612961 ] [ 0.593987 0.318141 0.061586 ] [ 0.045834 0.2737 0.919112 ] [ 0.317993 0.066453 0.584296 ] [ 0.059458 0.588814 0.321814 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "V" "Sn" "Sn" "Sn" "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" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.6039351 "source-unit" "angstrom" } "b" { "source-value" 8.63187935 "source-unit" "angstrom" } "c" { "source-value" 8.6490308 "source-unit" "angstrom" } "alpha" { "source-value" 64.24934925 "source-unit" "degree" } "beta" { "source-value" 64.53823067 "source-unit" "degree" } "gamma" { "source-value" 64.41086544 "source-unit" "degree" } }