Dear all, As is well known in electron-phonon calculations, one has to do a self consistent (scf) calculation over a dense electronic grid followed by an scf calculation on a coarse grid. The electron phonon calculation is usually performed after calculation the vibrational frequencies for each point.
My question is : If we increase the dense grid, Is it possible (Is there a way in QE) to compute the el-ph coefficients without recomputing the dynamical files (vibrational frequencies), which actually depend on the coarse grid. This would save a lot of time. Thanks in advance Ellie Moujaes Federal Universil of Rondonia Brazil
_______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
