{ "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" [ [ 0.324171 0.242712 0.501459 ] [ 0.318611 0.762999 0.508405 ] [ 0.685184 0.751287 0.744818 ] [ 0.325493 0.243296 0.997231 ] [ 0.669816 0.244301 0.249391 ] [ 0.671023 0.244886 0.748954 ] [ 0.845005 0.487909 0.996839 ] [ 0.8444 0.495822 0.510105 ] [ 0.322436 0.768263 0.987652 ] [ 0.683112 0.747357 0.262428 ] [ 0.81537 0.002799 0.990837 ] [ 0.186868 0.494183 0.249776 ] [ 0.821988 0.002673 0.498668 ] [ 0.181582 0.498534 0.750978 ] [ 0.690485 0.203156 0.552553 ] [ 0.690866 0.798103 0.549716 ] [ 0.772677 0.997041 0.840397 ] [ 0.107776 0.00376 0.528607 ] [ 0.781243 0.004768 0.340955 ] [ 0.319549 0.707085 0.798869 ] [ 0.692414 0.199192 0.054521 ] [ 0.103245 0.999182 0.029751 ] [ 0.321625 0.302817 0.303494 ] [ 0.327273 0.313897 0.808894 ] [ 0.898373 0.496368 0.299051 ] [ 0.89726 0.500611 0.79888 ] [ 0.185689 0.497666 0.092411 ] [ 0.190718 0.501401 0.594692 ] [ 0.320454 0.696067 0.304992 ] [ 0.689358 0.793345 0.05207 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Cu" "Cu" "P" "P" "P" "P" "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" 5.23318578865 "source-unit" "angstrom" } "b" { "source-value" 6.4184560326 "source-unit" "angstrom" } "c" { "source-value" 9.96937889813 "source-unit" "angstrom" } "alpha" { "source-value" 90.3465033823 "source-unit" "degree" } "beta" { "source-value" 90.0690822607 "source-unit" "degree" } "gamma" { "source-value" 90.5380471488 "source-unit" "degree" } }