{ "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" [ [ 0.373777 0.154357 0.555327 ] [ 0.48476 0.524008 0.999151 ] [ 0.623388 0.839058 0.436705 ] [ 0.245831 0.884084 0.082298 ] [ 0.806964 0.099881 0.957792 ] [ 0.027679 0.235454 0.700036 ] [ 0.669095 0.213446 0.326878 ] [ 0.770289 0.498876 0.727105 ] [ 0.216602 0.499425 0.266029 ] [ 0.332771 0.781039 0.675871 ] [ 0.976555 0.778927 0.302005 ] [ 0.91077 0.0761 0.735434 ] [ 0.510254 0.062378 0.327414 ] [ 0.901539 0.193521 0.451437 ] [ 0.25318 0.264993 0.760812 ] [ 0.633594 0.366309 0.770173 ] [ 0.994216 0.445398 0.797402 ] [ 0.651214 0.219788 0.122844 ] [ 0.143605 0.279545 0.172137 ] [ 0.683979 0.428342 0.471322 ] [ 0.308151 0.56595 0.519238 ] [ 0.812943 0.715827 0.811639 ] [ 0.355581 0.764372 0.876325 ] [ 0.004352 0.568089 0.198645 ] [ 0.367038 0.613582 0.22211 ] [ 0.751485 0.747061 0.247705 ] [ 0.10739 0.814422 0.550857 ] [ 0.496962 0.932506 0.678581 ] [ 0.086036 0.933262 0.256723 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "P" "P" "P" "P" "P" "P" "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" 7.32107185 "source-unit" "angstrom" } "b" { "source-value" 7.3844118 "source-unit" "angstrom" } "c" { "source-value" 7.52746851 "source-unit" "angstrom" } "alpha" { "source-value" 106.17656564 "source-unit" "degree" } "beta" { "source-value" 114.44162409 "source-unit" "degree" } "gamma" { "source-value" 97.21969185 "source-unit" "degree" } }