{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.79263 0.986765 0.2061 ] [ 0.79263 0.513235 0.2061 ] [ 0.20737 0.486765 0.7939 ] [ 0.20737 0.013235 0.7939 ] [ 0.249384 0.25 0.358635 ] [ 0.750616 0.75 0.641365 ] [ 0.278917 0.75 0.411352 ] [ 0.721083 0.25 0.588648 ] [ 0.260606 0.25 0.057414 ] [ 0.739394 0.75 0.942586 ] [ 0.71967 0.75 0.083219 ] [ 0.025654 0.25 0.121526 ] [ 0.478302 0.25 0.150551 ] [ 0.150193 0.935792 0.336727 ] [ 0.150193 0.564208 0.336727 ] [ 0.768322 0.25 0.415964 ] [ 0.594809 0.75 0.401893 ] [ 0.405191 0.25 0.598107 ] [ 0.231678 0.75 0.584036 ] [ 0.849807 0.435792 0.663273 ] [ 0.849807 0.064208 0.663273 ] [ 0.521698 0.75 0.849449 ] [ 0.974346 0.75 0.878474 ] [ 0.28033 0.25 0.916781 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Tm" "Tm" "P" "P" "C" "C" "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" 4.9016846 "source-unit" "angstrom" } "b" { "source-value" 6.74673191 "source-unit" "angstrom" } "c" { "source-value" 8.96827333 "source-unit" "angstrom" } "beta" { "source-value" 92.81541799 "source-unit" "degree" } }