[Pw_users] Quantum ESPRESSO v.4.2
Paolo Giannozzi
giannozz at democritos.it
Wed May 12 11:47:07 CEST 2010
Version 4.2 of the Quantum ESPRESSO distribution is available for
download from the website http://www.quantum-espresso.org . This
release contains the following improvements over previous versions:
* HSE exchange-correlation functionals (courtesy of Hannu-Pekka
Komsa)
* New package GWW for GW calculations with Wannier functions
(courtesy of Geoffrey Stenuit and Paolo Umari)
* Grid parallelization for the phonon code
* Improved mixed openMP-MPI parallelization
* Martyna-Tuckerman algorithm for isolated systems
plus other minor improvements and bug fixes (see file Doc/release-
notes).
Everybody who is using the Quantum-ESPRESSO distribution is encouraged
to upgrade and to report problems to the mailing list.
The Quantum ESPRESSO group
---
Paolo Giannozzi, Democritos and University of Udine, Italy
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