{ "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" [ [ 0.80087 0.117616 0.997848 ] [ 0.161267 0.307249 0.504347 ] [ 0.494348 0.494747 0.006408 ] [ 0.524151 0.760837 0.745638 ] [ 0.4869 0.223527 0.249613 ] [ 0.522508 0.032834 0.498752 ] [ 0.82848 0.657305 0.493543 ] [ 0.190572 0.86869 0.995501 ] [ 0.788231 0.39573 0.752989 ] [ 0.159121 0.079011 0.749741 ] [ 0.170208 0.59071 0.249598 ] [ 0.859012 0.965716 0.249701 ] [ 0.854491 0.075212 0.639265 ] [ 0.158909 0.222716 0.13334 ] [ 0.492226 0.132566 0.869246 ] [ 0.85315 0.304002 0.366887 ] [ 0.486177 0.357798 0.633059 ] [ 0.503394 0.853299 0.137642 ] [ 0.860812 0.786548 0.861515 ] [ 0.139023 0.929854 0.361551 ] [ 0.165062 0.456342 0.87536 ] [ 0.498398 0.63286 0.37957 ] [ 0.166308 0.712242 0.624752 ] [ 0.836383 0.542592 0.124137 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Fe" "Fe" "Fe" "Fe" "O" "O" "O" "O" "O" "O" "O" "O" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.16956102 "source-unit" "angstrom" } "b" { "source-value" 5.19022365 "source-unit" "angstrom" } "c" { "source-value" 9.89205595 "source-unit" "angstrom" } "alpha" { "source-value" 100.18817705 "source-unit" "degree" } "beta" { "source-value" 85.5907613 "source-unit" "degree" } "gamma" { "source-value" 119.31631209 "source-unit" "degree" } }