{ "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" [ [ 0.828689 0.576178 0.192392 ] [ 0.387275 0.75995 0.962427 ] [ 0.212921 0.646561 0.382253 ] [ 0.787079 0.353439 0.617747 ] [ 0.612725 0.24005 0.037573 ] [ 0.171311 0.423822 0.807608 ] [ 0.5 0 0.5 ] [ 0.874136 0.791046 0.719483 ] [ 0.125864 0.208954 0.280517 ] [ 0.200196 0.782842 0.7024 ] [ 0.303554 0.955196 0.220532 ] [ 0.810498 0.710302 0.479273 ] [ 0.764369 0.573642 0.893982 ] [ 0.235631 0.426358 0.106018 ] [ 0.189502 0.289698 0.520727 ] [ 0.696446 0.044804 0.779468 ] [ 0.799804 0.217158 0.2976 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Fe" "Si" "Si" "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" 5.14628463 "source-unit" "angstrom" } "b" { "source-value" 5.56973265 "source-unit" "angstrom" } "c" { "source-value" 6.21964569 "source-unit" "angstrom" } "alpha" { "source-value" 88.13299137 "source-unit" "degree" } "beta" { "source-value" 79.14345153 "source-unit" "degree" } "gamma" { "source-value" 85.96617711 "source-unit" "degree" } }