Hot answers tagged

3 votes

Calculating lattice thermal conductivity using Quantum ESPRESSO and phonopy

Some years ago I found the following steps in ResearchGate: You need: QuantumEspresso (QE) Phono3py ShengBTE & thirdorder.py First, you need to create a QE input file (...
  • 19.3k

Only top scored, non community-wiki answers of a minimum length are eligible