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?
_______________________________________________
Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
users mailing list [email protected]
https://lists.quantum-espresso.org/mailman/listinfo/users
--
Lorenzo Paulatto - Paris
_______________________________________________
Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
users mailing list [email protected]
https://lists.quantum-espresso.org/mailman/listinfo/users
