{ "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" [ [ 0.541635 0.454339 0.921262 ] [ 0.451712 0.499183 0.691771 ] [ 0.955996 0.005911 0.406043 ] [ 0.923798 0.991877 0.598579 ] [ 0.69668 0.562667 0.100626 ] [ 0.554814 0.536981 0.323161 ] [ 0.952043 0.964831 0.786826 ] [ 0.077569 0.035048 0.024561 ] [ 0.450266 0.507459 0.506206 ] [ 0.123967 0.083452 0.201562 ] [ 0.722744 0.12174 0.859222 ] [ 0.381149 0.813326 0.029116 ] [ 0.19571 0.824562 0.51723 ] [ 0.660515 0.648434 0.583807 ] [ 0.167101 0.812945 0.687122 ] [ 0.117562 0.855357 0.281534 ] [ 0.176711 0.743831 0.836932 ] [ 0.267542 0.444182 0.424039 ] [ 0.879067 0.765045 0.000848 ] [ 0.702266 0.672319 0.426017 ] [ 0.192194 0.232924 0.942893 ] [ 0.271504 0.330603 0.582918 ] [ 0.696582 0.266422 0.018318 ] [ 0.681832 0.820924 0.741778 ] [ 0.099174 0.305102 0.09633 ] [ 0.072795 0.270515 0.745902 ] [ 0.94668 0.38217 0.236236 ] [ 0.62774 0.134092 0.34288 ] [ 0.713577 0.20322 0.497653 ] [ 0.991986 0.861377 0.132888 ] [ 0.475209 0.117283 0.187619 ] ] } "species" { "source-value" [ "Bi" "Bi" "Bi" "Bi" "Bi" "Bi" "W" "W" "W" "W" "O" "O" "O" "O" "O" "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" 5.05780458 "source-unit" "angstrom" } "b" { "source-value" 5.10072775 "source-unit" "angstrom" } "c" { "source-value" 18.61962826 "source-unit" "angstrom" } "alpha" { "source-value" 87.45558056 "source-unit" "degree" } "beta" { "source-value" 86.26522322 "source-unit" "degree" } "gamma" { "source-value" 85.12147255 "source-unit" "degree" } }