[Q-e-developers] problem with PAW + stess + Hubbard U

Nicola Marzari nicola.marzari at epfl.ch
Mon Jan 20 15:28:27 CET 2014


On 20/01/2014 15:23, Paolo Giannozzi wrote:
> 0) what is the current situation
> 1) what should be the ideal situation
> 2) how to go from 0) to 1) without breaking too many things.
> In the meantime: what is done, good or bad, should be done in
> the same way everywhere.


"Zen and the Art of Quantum-ESPRESSO Maintenance" !

			nicola

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Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL



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