[QE-users] 3drism-enabled qe

[Nicola Marzari]

On 08/04/2020 15:28, Shaofeng Wang wrote:
> 3drism-enabled qe


Google points to this:
https://www.quantum-espresso.org/download
(not sure if it's 3D-RISM or 1D-RISM).

For solvation and electrolytes, Oliviero Andreussi and some of us 
develop also quite actively http://www.quantum-environ.org

			nicola

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Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL
Director, National Centre for Competence in Research NCCR MARVEL, EPFL
http://theossrv1.epfl.ch/Main/Contact http://nccr-marvel.ch/en/project