[QE-users] phonon dos

Sohail Ahmad sohailphysics at yahoo.co.in
Sat Dec 5 12:58:30 CET 2020


Dear QEusers,
 I am using QE 6.5 and got dispersion curve but it gives error in calculating phonon dos
pls check input, if there is any error

&input
 asr = 'simple',
 dos = '.true.',
 amass(1) = 51.99,
 amass(2) = 28.08,
 amass(3) = 58.69,
 flfrc = 'NiCrSi.fc',
 fldos = 'NiCrSi.phdos',
 nk1 = 8, nk2 = 8, nk3 = 8,
/




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Dr. Sohail Ahmad

Department of Physics

Faculty of Science, P. O. Box - 9004

King Khalid University

Abha, Saudi Arabia


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