Q-Espresso

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Q-ESPRESSO

Version: 0.0.3

Author(s): Celso R. C. Rego, celsorego@kit.edu

dft vdw_corr input_dft
...

This WaNo performs DFT calculations

Source:
https://git.scc.kit.edu/AG_Wenzel/wanos/q-espresso

README.md

Q-ESPRESSO

This WaNo performs DFT calculations using Qquatum Espresso code. Here the PW projectors are generated automatically after the specification of the chemical species.