{ "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" [ [ 0.997607 0.753146 0.992638 ] [ 0.997607 0.246854 0.992638 ] [ 0.500559 0.246351 0.50704 ] [ 0.500559 0.753649 0.50704 ] [ 0.029288 0.5 0.723813 ] [ 0.474634 0.5 0.214035 ] [ 0.536376 0 0.784787 ] [ 0.976969 0 0.28453 ] [ 0.098677 0 0.6028 ] [ 0.420768 0 0.076238 ] [ 0.589884 0.5 0.907247 ] [ 0.888507 0.5 0.415221 ] [ 0.232295 0 0.471129 ] [ 0.224677 0.800985 0.670047 ] [ 0.224677 0.199015 0.670047 ] [ 0.202728 0.5 0.397865 ] [ 0.271679 0.5 0.902804 ] [ 0.30762 0.799699 0.147369 ] [ 0.30762 0.200301 0.147369 ] [ 0.275947 0 0.94696 ] [ 0.712844 0.5 0.040874 ] [ 0.719869 0.30334 0.838411 ] [ 0.719869 0.69666 0.838411 ] [ 0.736435 0 0.065925 ] [ 0.780673 0 0.600539 ] [ 0.739657 0.307055 0.350821 ] [ 0.739657 0.692945 0.350821 ] [ 0.792323 0.5 0.552584 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "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" 4.84118913 "source-unit" "angstrom" } "b" { "source-value" 6.30105213 "source-unit" "angstrom" } "c" { "source-value" 10.80928493 "source-unit" "angstrom" } "beta" { "source-value" 90.21903879 "source-unit" "degree" } }