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--></style></head><body lang=EN-US link=blue vlink="#954F72"><div class=WordSection1><p class=MsoNormal>Dear Prof. Sitangshu Bhattacharya,</p><p class=MsoNormal><o:p> </o:p></p><p class=MsoNormal>Thank you for your reply. But what do you mean by ‘scf report file’? Is it the output file of scf calculation? I don’t see the symmetry information in the output file of scf calculation.</p><p class=MsoNormal><o:p> </o:p></p><p class=MsoNormal>For the pseudopotential, I tested them. The consistent between the AE energy and PS energy is well as well as the logarithmic derivatives. I also tested them in band-structure calculations, and they also produced nearly the same band structures with other PPs provided by quantum espresso PP library. And the phonon dispersion calculated with these PPs seem reasonable.</p><p class=MsoNormal><o:p> </o:p></p><p class=MsoNormal>And by the way, I could not view the pictures you posted.</p><p class=MsoNormal><o:p> </o:p></p><p class=MsoNormal>Best regards</p><p class=MsoNormal>Zhishuo Huang</p><p class=MsoNormal><o:p> </o:p></p></div></body></html>