[Pw_forum] Phonons calcultation at Gamma
Dear QE users ans developers, I did the phonons calculation of the binary AlN (rocksalt) with 16 atoms . My output files is as following: Diagonalizing the dynamical matrix q = (0.0 0.0 0.0 ) *
[Pw_forum] Phonons calcultation at Gamma
Check the dynamical matrix file, produced by ph.x at the end of the run, there you will also have the phonon displacements. kind regards On 22 September 2014 18:27, Said Asma wrote: > Dear QE users ans developers, > > I did the phonons calculation of the binary AlN (rocksalt) with 16 atoms . >