{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.79218 0.5 0.69234 ] [ 0.29218 0 0.69234 ] [ 0.097631 0.5 0.703708 ] [ 0.898357 0.5 0.280426 ] [ 0.199845 0.5 0.277706 ] [ 0.597631 0 0.703708 ] [ 0.398357 0 0.280426 ] [ 0.699845 0 0.277706 ] [ 0.867631 0 0.31034 ] [ 0.756937 0 0.6434 ] [ 0.140126 0.5 0.011169 ] [ 0.054093 0.5 0.369152 ] [ 0.946337 0.5 0.644686 ] [ 0.870273 0.5 0.022462 ] [ 0.241214 0 0.336094 ] [ 0.135375 0 0.708516 ] [ 0.367631 0.5 0.31034 ] [ 0.256937 0.5 0.6434 ] [ 0.640126 0 0.011169 ] [ 0.554093 0 0.369152 ] [ 0.446337 0 0.644686 ] [ 0.370273 0 0.022462 ] [ 0.741214 0.5 0.336094 ] [ 0.635375 0.5 0.708516 ] ] } "species" { "source-value" [ "Mn" "Mn" "V" "V" "V" "V" "V" "V" "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" 12.0316503 "source-unit" "angstrom" } "b" { "source-value" 3.80823361 "source-unit" "angstrom" } "c" { "source-value" 6.63740225 "source-unit" "angstrom" } "beta" { "source-value" 106.69723468 "source-unit" "degree" } }