Given an input structure, generates a set of phonon configurations. Uses the pm-asephonons tool from pymuon-suite. |
hg clone https://toolshed.g2.bx.psu.edu/repos/muon-spectroscopy-computational-project/pm_asephonons
Name | Description | Version | Minimum Galaxy Version |
---|---|---|---|
calculate phonons using ASE and DFTB+ | 0.3.0+galaxy1 | 22.05 |