{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.469837 0.25349 0.995169 ] [ 0.016388 0.000085 0.742908 ] [ 0.530163 0.74651 0.004831 ] [ 0.983612 0.999915 0.257092 ] [ 0.932498 0.488301 0.740499 ] [ 0.067502 0.511699 0.259501 ] [ 0.507744 0.239012 0.500662 ] [ 0.492256 0.760988 0.499338 ] [ 0.687182 0.088727 0.400662 ] [ 0.312818 0.911273 0.599338 ] [ 0.27704 0.830523 0.198436 ] [ 0.72296 0.169477 0.801564 ] [ 0.286742 0.408278 0.569262 ] [ 0.713258 0.591722 0.430738 ] [ 0.709874 0.637596 0.79403 ] [ 0.290126 0.362404 0.20597 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Pb" "Pb" "Pb" "Pb" "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" 6.58841615205 "source-unit" "angstrom" } "b" { "source-value" 7.12282695363 "source-unit" "angstrom" } "c" { "source-value" 7.62265703774 "source-unit" "angstrom" } "alpha" { "source-value" 117.538734109 "source-unit" "degree" } "beta" { "source-value" 93.6697269697 "source-unit" "degree" } "gamma" { "source-value" 104.882896856 "source-unit" "degree" } }