[ Bron: espresso ]
Pakket: quantum-espresso-data (6.3-4)
Verwijzigingen voor quantum-espresso-data
Debian bronnen:
Het bronpakket espresso downloaden:
Beheerders:
Externe bronnen:
- Homepage [www.quantum-espresso.org]
Vergelijkbare pakketten:
Electronic-Structure and Ab-Initio Molecular Dynamics Suite (Documentation)
Quantum ESPRESSO is an integrated suite of computer codes for electronic-structure calculations and materials modeling at the nanoscale. It is based on density-functional theory, plane waves, and pseudopotentials (both norm-conserving, ultrasoft, and PAW).
This package contains a limited set of pseudo-potentials and example files.