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Automatic workflows for yambo using python able to:

  • Create Yambo input files using a transparent python script
  • Collect the output data in .json files for posterior analysis
  • Plot the results using matplotlib
  • Create Quantum Espresso input files using python

You can download in yambopy.

Electron-phonon scripts

Electron-phonon interaction calculations requires to obtain electronic states, phonon states and the electron-phonon interaction matrix elements. The calculation of the electron-phonon interaction requires many intermediate steps. In order to facilitate the task we have developed a set of scripts to automatize the workflow. More details are available in the tutorial.