{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.156667 0.242022 0.578719 ] [ 0.001916 0.783797 0.727818 ] [ 0.82605 0.25954 0.921834 ] [ 0.177196 0.264778 0.091801 ] [ 0.156667 0.757978 0.078719 ] [ 0.840175 0.245712 0.41779 ] [ 0.001916 0.216203 0.227818 ] [ 0.82605 0.74046 0.421834 ] [ 0.177196 0.735222 0.591801 ] [ 0.840175 0.754288 0.91779 ] [ 0.656667 0.742022 0.578719 ] [ 0.501916 0.283797 0.727818 ] [ 0.32605 0.75954 0.921834 ] [ 0.677196 0.764778 0.091801 ] [ 0.656667 0.257978 0.078719 ] [ 0.340175 0.745712 0.41779 ] [ 0.501916 0.716203 0.227818 ] [ 0.32605 0.24046 0.421834 ] [ 0.677196 0.235222 0.591801 ] [ 0.340175 0.254288 0.91779 ] [ 0.00084 0.677743 0.30446 ] [ 0.00084 0.322257 0.80446 ] [ 0.50084 0.177743 0.30446 ] [ 0.50084 0.822257 0.80446 ] [ 0.000357 0.036459 0.961318 ] [ 0.158234 0.514447 0.327847 ] [ 0.000357 0.963541 0.461318 ] [ 0.8442 0.488849 0.674419 ] [ 0.158234 0.485553 0.827847 ] [ 0.8442 0.511151 0.174419 ] [ 0.500357 0.536459 0.961318 ] [ 0.658234 0.014447 0.327847 ] [ 0.500357 0.463541 0.461318 ] [ 0.3442 0.988849 0.674419 ] [ 0.658234 0.985553 0.827847 ] [ 0.3442 0.011151 0.174419 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Si" "Si" "Si" "Si" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 12.82369143 "source-unit" "angstrom" } "b" { "source-value" 5.93444188 "source-unit" "angstrom" } "c" { "source-value" 8.63071283 "source-unit" "angstrom" } "beta" { "source-value" 109.47140212 "source-unit" "degree" } }