{ "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" [ [ 0.984232 0.247532 0.448996 ] [ 0.015768 0.752468 0.551004 ] [ 0 0 0 ] [ 0.558258 0.19101 0.784667 ] [ 0.434554 0.594756 0.781124 ] [ 0.565446 0.405244 0.218876 ] [ 0.441742 0.80899 0.215333 ] [ 0.776651 0.124947 0.643918 ] [ 0.701468 0.319019 0.003197 ] [ 0.713163 0.981773 0.209068 ] [ 0.462395 0.368872 0.755848 ] [ 0.271625 0.249448 0.212463 ] [ 0.775207 0.451312 0.36565 ] [ 0.224793 0.548688 0.63435 ] [ 0.728375 0.750552 0.787537 ] [ 0.537605 0.631128 0.244152 ] [ 0.286837 0.018227 0.790932 ] [ 0.298532 0.680981 0.996803 ] [ 0.223349 0.875053 0.356082 ] ] } "species" { "source-value" [ "Li" "Li" "Fe" "P" "P" "P" "P" "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" 5.01109963 "source-unit" "angstrom" } "b" { "source-value" 7.14896934 "source-unit" "angstrom" } "c" { "source-value" 7.56636058 "source-unit" "angstrom" } "alpha" { "source-value" 114.90127481 "source-unit" "degree" } "beta" { "source-value" 82.96386971 "source-unit" "degree" } "gamma" { "source-value" 109.10532105 "source-unit" "degree" } }