Dear siesta developers and users 1. I have obtained the optimization structure by Broyden type MD at a sparse k grid sampling. In order to get the optimized structure at a dense k grid sampling, can I just restart the calculation with adding the commands in the .fdf file. MD.UseSaveCG T MD.UseSaveXV T DM.UseSaveDM true 2. For the band structure calculations, can I get the band structure at a dense k grid sampling just restarting the previous calculation (converged in a sparse k grid) with the above commards. Any suggestion or comment is appreciated. Sincerely Fei Mao University of South China, China
