{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.928687 0.5 0.714303 ] [ 0.550526 0.5 0.220706 ] [ 0.421462 0 0.782657 ] [ 0.041541 0 0.279783 ] [ 0.90821 0 0.604149 ] [ 0.602241 0 0.093279 ] [ 0.413488 0.5 0.895243 ] [ 0.080172 0.5 0.4099 ] [ 0.832085 0 0.452467 ] [ 0.772341 0.199892 0.673005 ] [ 0.772341 0.800108 0.673005 ] [ 0.781405 0.5 0.388997 ] [ 0.720458 0.5 0.874158 ] [ 0.753263 0.19505 0.166376 ] [ 0.753263 0.80495 0.166376 ] [ 0.646487 0 0.942962 ] [ 0.355174 0.5 0.04397 ] [ 0.274042 0.699843 0.823631 ] [ 0.274042 0.300157 0.823631 ] [ 0.298823 0 0.121846 ] [ 0.21557 0 0.617943 ] [ 0.22379 0.701085 0.336466 ] [ 0.22379 0.298915 0.336466 ] [ 0.156795 0.5 0.55868 ] ] } "species" { "source-value" [ "Mn" "Mn" "Mn" "Sn" "P" "P" "P" "P" "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" 4.99615866 "source-unit" "angstrom" } "b" { "source-value" 6.07957613 "source-unit" "angstrom" } "c" { "source-value" 10.0011886 "source-unit" "angstrom" } "beta" { "source-value" 90.29626086 "source-unit" "degree" } }