Useful links for Quantum Espresso: Difference between revisions
New page: Main Quantum Espresso website: http://www.quantum-espresso.org/ Quantum Espresso default pseudopotentials: http://www.quantum-espresso.org/pseudopotentials/ Quantum Espresso advanced pse... |
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Go back to [[Scripts_for_QE]] | |||
Main Quantum Espresso website: | Main Quantum Espresso website: | ||
http://www.quantum-espresso.org/ | http://www.quantum-espresso.org/ | ||
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http://theory.cm.utexas.edu/henkelman/code/bader/ | http://theory.cm.utexas.edu/henkelman/code/bader/ | ||
Mailing list and | Mailing list and pw_forum | ||
http://www.qe-forge.org/mailman/listinfo/pw_forum | |||
Revision as of 14:21, 12 December 2017
Go back to Scripts_for_QE
Main Quantum Espresso website: http://www.quantum-espresso.org/
Quantum Espresso default pseudopotentials: http://www.quantum-espresso.org/pseudopotentials/
Quantum Espresso advanced pseudopotentials: http://materialscloud.org/sssp http://people.sissa.it/~dalcorso/pslibrary/index.html
Quantum Espresso User manual http://www.quantum-espresso.org/users-manual/
General Input File Description: http://www.quantum-espresso.org/users-manual/input-data-description
pw.x Input File Description: http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_PW.html
projwfc.x Input File Description: http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_PROJWFC.html
pp.x Input File Description: http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_PP.html
Data transfer between different architecture: http://www.quantum-espresso.org/wp-content/uploads/Doc/pw_user_guide/node9.html
Environ plug-in: http://www.quantum-environment.org/home.html
Bader software to compute Bader charges: http://theory.cm.utexas.edu/henkelman/code/bader/
Mailing list and pw_forum http://www.qe-forge.org/mailman/listinfo/pw_forum