{ "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" [ [ 0.939233 0 0.634258 ] [ 0.822884 0 0.996271 ] [ 0.062085 0 0.367534 ] [ 0.439233 0.5 0.634258 ] [ 0.322884 0.5 0.996271 ] [ 0.562085 0.5 0.367534 ] [ 0.785741 0.5 0.696594 ] [ 0.285741 0 0.696594 ] [ 0.208662 0.5 0.305892 ] [ 0.892094 0.5 0.301458 ] [ 0.104303 0.5 0.708895 ] [ 0.708662 0 0.305892 ] [ 0.392094 0 0.301458 ] [ 0.604303 0 0.708895 ] [ 0.860937 0.5 0.023739 ] [ 0.87944 0 0.31274 ] [ 0.941071 0.5 0.625672 ] [ 0.761744 0 0.652348 ] [ 0.231105 0 0.328247 ] [ 0.059223 0.5 0.37154 ] [ 0.158317 0.5 0.991258 ] [ 0.1052 0 0.67788 ] [ 0.360937 0 0.023739 ] [ 0.37944 0.5 0.31274 ] [ 0.441071 0 0.625672 ] [ 0.261744 0.5 0.652348 ] [ 0.731105 0.5 0.328247 ] [ 0.559223 0 0.37154 ] [ 0.658317 0 0.991258 ] [ 0.6052 0.5 0.67788 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "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" 12.5153172 "source-unit" "angstrom" } "b" { "source-value" 4.07800964 "source-unit" "angstrom" } "c" { "source-value" 6.61762853 "source-unit" "angstrom" } "beta" { "source-value" 107.58701713 "source-unit" "degree" } }