{ "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" [ [ 0.661452 0.321778 0.908303 ] [ 0.995945 0.995101 0.988069 ] [ 0.009136 0.01023 0.486768 ] [ 0.331398 0.668365 0.409414 ] [ 0.829555 0.659268 0.210359 ] [ 0.166414 0.827676 0.713653 ] [ 0.659655 0.825895 0.713485 ] [ 0.341919 0.167426 0.216728 ] [ 0.830384 0.167332 0.213962 ] [ 0.171983 0.340207 0.714693 ] [ 0.666086 0.33473 0.48483 ] [ 0.327538 0.643711 0.98612 ] [ 0.35655 0.200763 0.587474 ] [ 0.507137 0.04268 0.354619 ] [ 0.664827 0.339333 0.113161 ] [ 0.999945 0.988018 0.298185 ] [ 0.99268 0.986786 0.800419 ] [ 0.830333 0.185416 0.580436 ] [ 0.508853 0.476572 0.348505 ] [ 0.958145 0.497561 0.356377 ] [ 0.183236 0.343716 0.089927 ] [ 0.831831 0.672 0.59087 ] [ 0.036136 0.507469 0.857106 ] [ 0.481291 0.512062 0.857097 ] [ 0.341063 0.685317 0.612369 ] [ 0.184768 0.833182 0.086867 ] [ 0.475391 0.948537 0.844468 ] [ 0.656052 0.818872 0.083578 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Fe" "Fe" "Fe" "W" "W" "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" 5.95671507 "source-unit" "angstrom" } "b" { "source-value" 6.02620087 "source-unit" "angstrom" } "c" { "source-value" 9.83275187 "source-unit" "angstrom" } "alpha" { "source-value" 91.19895342 "source-unit" "degree" } "beta" { "source-value" 90.2525702 "source-unit" "degree" } "gamma" { "source-value" 119.39087084 "source-unit" "degree" } }