{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.290447 0.90155 0.33918 ] [ 0.964415 0.315361 0.273565 ] [ 0.455455 0.377853 0.685237 ] [ 0.738791 0.698646 0.998042 ] [ 0.290447 0.09845 0.83918 ] [ 0.455455 0.622147 0.185237 ] [ 0.964415 0.684639 0.773565 ] [ 0.738791 0.301354 0.498042 ] [ 0.012248 0.18148 0.002821 ] [ 0.012248 0.81852 0.502821 ] [ 0.70919 0.257396 0.974779 ] [ 0.094706 0.124516 0.523413 ] [ 0.298552 0.726085 0.72894 ] [ 0.913265 0.700196 0.294576 ] [ 0.70919 0.742604 0.474779 ] [ 0.094706 0.875484 0.023413 ] [ 0.298552 0.273915 0.22894 ] [ 0.913265 0.299804 0.794576 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Mn" "Mn" "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" 6.29912428 "source-unit" "angstrom" } "b" { "source-value" 5.73698591 "source-unit" "angstrom" } "c" { "source-value" 9.78261558 "source-unit" "angstrom" } "beta" { "source-value" 129.28326202 "source-unit" "degree" } }