Try something like this%block ProjectedDensityOfStates -25.00 20.00 0.100 1500 eV %endblock ProjectedDensityOfStates
Dr. Gul Rahman Assistant Professor, Department of Physics, Quaid-i-Azam University, Islamabad, Pakistanhttp://www.qau.edu.pk/profile.php?id=818020 On Monday, 10 August 2015, 18:38, 毛飞 <[email protected]> wrote: Dear Siesta Developers and Users I am trying to calculate DOS and PDOS. To calculate both I add a block label in the input file, such us:%block ProjectedDensityOfSTates -10.0 10.0 0.05 700 eV%endblock ProjectedDensityOfStatesI obtain two output files SystemLabel.DOS and SystemLabel.PDOS. However, the *.DOS is totally empty, and the content in the *.PDOS is, <pdos><nspin>1</nspin><norbitals> 18</norbitals><energy_values units="eV"></energy_values> It is strange, I cannot understand these results, and I have searched the mail archive of Siesta, but I don’t find the explanations to this problem. Dose anybody encounter the problem before? I am using the version of siesta-3.2-pl-5. Regards Fei Mao USC
