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pranabdas / espresso

Notes and tutorials on Density Functional Theory calculation using Quantum Espresso.
https://pranabdas.github.io/espresso/
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fix: GaAs phonon calculation #34

Closed pranabdas closed 3 months ago

pranabdas commented 3 months ago

The default value of q_in_cryst_coord is incorrect in GaAs phonon calculation as described in https://github.com/pranabdas/espresso/issues/33. Thanks to @Tosykie for reporting the problem.

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