[QE-users] phono3py

[Lorenzo Paulatto]

Hello,
you should really ask to the phono3py mailing list :
https://sourceforge.net/projects/phonopy/lists/phonopy-users

cheers

On 7/2/20 7:59 AM, tanmay chaki wrote:
> I wish to calculate the lattice thermal conductivity by phono3py using 
> QE. What will be the steps for this? I am working on a ternary 
> skutterudite which has 17 atoms per molecule. So is the calculation 
> possible in a 2*10 core xenon prosessor based based work station with 64 
> gb RAM?
> 
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-- 
Lorenzo Paulatto - Paris