How to cite?
Quantum ESPRESSO is an Open Source distribution. We shall greatly appreciate if scientific work done using Quantum ESPRESSO will contain an explicit acknowledgement and the following references:
P. Giannozzi et al., J.Phys.:Condens.Matter 21, 395502 (2009) http://dx.doi.org/10.1088/0953-8984/21/39/395502
P. Giannozzi et al., J.Phys.:Condens.Matter 29, 465901 (2017) http://iopscience.iop.org/article/10.1088/1361-648X/aa8f79
and if you used the GPU-enabled version of the code:
P. Giannozzi et al., J. Chem. Phys. 152, 154105 (2020) https://doi.org/10.1063/5.0005082
How to download?
Sources: Quantum ESPRESSO is currently distributed as source packages, but selected binary packages for Linux, Mac-OS X and Windows are also available. The current stable version can be downloaded from:
- GitHub (recommended), or alternatively from
- GitLab (click on the "cloud with a down arrow" to download);
- GitLab repository of GPU-enabled version.
Please read the "release-notes" file for information on major changes and problems. Patches and updates are available on GitHub: see the "Assets" list at the end of the release notes. The latest development version, in branch "develop", is available on GitLab and mirrored on GitHub.
The Schrödinger-enabled version of Quantum ESPRESSO can be downloaded here.
The RISM-enabled version of Quantum ESPRESSO can be downloaded from Satomichi Nishihara's git repository.
Virtual Machine: A fully configured Ubuntu virtual machine that can be run from Windows/Mac-OS x/Linux/Solaris is available on the Materials Cloud site. It contains Quantum ESPRESSO and much more (4Gb).
Binary packages for Mac-OS X are available in the Science section of Macports.
(last updated: Jun 1, 2020)