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Quantum Espresso

Created Tuesday 23 August 2016

Webpage

Official web site
http://www.quantum-espresso.org/download/

Quantum Espresso with HDF5/adios support
https://github.com/nvarini/espresso_iohpc

Quantum Espresso optimized by NERSC

http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_CP.html

Compilation

Run

Notes

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Backlinks: Software Software:Chemistry