>From the documentation: https://www.quantum-espresso.org/Doc/INPUT_PROJWFC.html In the non-collinear, spin-orbit case (i.e. if there is at least one fully relativistic pseudopotential) wavefunctions are projected onto eigenstates of the total angular-momentum. Projected DOS are written to file "filpdos".pdos_atm#N(X)_wfc#M(l_j), where N = atom number , X = atom symbol, M = wfc number, l=s,p,d,f and j is the value of the total angular momentum.
So, you should definitely get PDOS for individual atoms. No other hint can be provided unless you provide more information (e.g. list of files you find after running projwfc.x, output or part of it of projwfc,it, and so on). Giovanni -- Prof. Giovanni Cantele Dipartimento di Fisica "Ettore Pancini" Universita' degli Studi di Napoli "Federico II" Complesso Universitario M. S. Angelo - Ed. 6 Via Cintia, I-80126, Napoli, Italy e-mail: [email protected] Phone: +39 081 676910 Web page: https://sites.google.com/view/giovanni-cantele/home Il giorno dom 8 mar 2026 alle ore 19:56 A.K.Md.Farid ul Islam via users < [email protected]> ha scritto: > Dear, > when i run projwfc.x for SOC system, i cannot get pdos for individual > atoms of that system. How can i overcome it. > Dr. Farid > > _______________________________________________________________________________ > The Quantum ESPRESSO Foundation stands in solidarity with all civilians > worldwide who are victims of terrorism, military aggression, and > indiscriminate warfare. > > -------------------------------------------------------------------------------- > Quantum ESPRESSO is supported by MaX (www.max-centre.eu) > users mailing list [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users
_______________________________________________________________________________ The Quantum ESPRESSO Foundation stands in solidarity with all civilians worldwide who are victims of terrorism, military aggression, and indiscriminate warfare. -------------------------------------------------------------------------------- Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
