This is a collection of input and output files that were used to produce all the data reported
in the following publication:
Pietro Delugas, Oscar Baseggio, Iurii Timrov, Stefano Baroni, and Tommaso Gorni,
"Magnon-phonon interactions enhance the gap at the Dirac point in the spin-wave
spectra of CrI3 two-dimensional magnets", accepted to Phys. Rev. B, arXiv:2105.04531
Calculations were performed using the open-source Quantum ESPRESSO distribution
which can be downloaded from www.quantum-espresso.org.
The following codes of Quantum ESPRESSO were used:
pw.x - the code that performs ground-state DFT calculations
ph.x - the code to compute phonons using DFPT
turbo_magnon.x - the code to compute magnons using TDDFPT
turbo_spectrum.x - the post-processing program to plot the magnetic spectra
DESCRIPTION OF FOLDERS:
- Magnons_TDDFPT: files to compute magnons using TDDFPT
- Magnon-phonon-dispersion: files to compute phonons using DFPT and to plot the magnon-phonon dispersion
- Magnons_3D_plot: 3D plot of the magnon dispersion using Mathematica