{ "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" [ [ 0.666328 0.338981 0.106098 ] [ 0.000059 0.996002 0.003944 ] [ 0.998801 0.003302 0.504473 ] [ 0.341294 0.678827 0.605088 ] [ 0.657807 0.839312 0.28589 ] [ 0.831014 0.662084 0.78902 ] [ 0.160136 0.825531 0.289958 ] [ 0.668321 0.333083 0.516039 ] [ 0.33018 0.654601 0.016614 ] [ 0.834823 0.17279 0.784851 ] [ 0.339303 0.170687 0.785105 ] [ 0.171871 0.337445 0.286952 ] [ 0.834182 0.163138 0.398767 ] [ 0.524062 0.046078 0.658172 ] [ 0.680665 0.357112 0.896686 ] [ 0.990579 0.981437 0.689716 ] [ 0.994591 0.992906 0.189372 ] [ 0.326568 0.144691 0.397176 ] [ 0.962107 0.496048 0.660944 ] [ 0.533546 0.494091 0.66146 ] [ 0.160413 0.318838 0.90131 ] [ 0.827666 0.674097 0.392715 ] [ 0.478036 0.517546 0.159958 ] [ 0.041729 0.537903 0.162318 ] [ 0.336882 0.671619 0.398375 ] [ 0.667878 0.815465 0.894695 ] [ 0.492331 0.959644 0.16211 ] [ 0.149125 0.816744 0.894355 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "V" "Cr" "Cr" "Fe" "Fe" "Fe" "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" 5.89968706 "source-unit" "angstrom" } "b" { "source-value" 5.91981218 "source-unit" "angstrom" } "c" { "source-value" 9.59248148 "source-unit" "angstrom" } "alpha" { "source-value" 90.86040814 "source-unit" "degree" } "beta" { "source-value" 90.11204497 "source-unit" "degree" } "gamma" { "source-value" 119.84113672 "source-unit" "degree" } }