QUANTUMESPRESSO

Quantum ESPRESSO v.6.1

giannozz — Fri, 03 Mar 2017 09:49:33 +0000

Version 6.1 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here

Schrödinger extends Materials Science capabilities through integration with QE

qewpadmin — Wed, 01 Feb 2017 16:24:55 +0000

Schrödinger Inc. and the Quantum ESPRESSO Foundation (QEF) are pleased to announce the integration of the Quantum ESPRESSO software into Schrödinger’s Materials Science Suite to enable expanded use offirst-principles simulation in industrial and academic research laboratories. The December 2016 release of the Schrödinger Materials Science Suite includes for the first time interfaces to Quantum ESPRESSO for simulation set-up and property analysis, making simulation of crystalline materials and surfaces accessible to both experts and non-experts alike. This new development is the result of an ongoing collaboration between Schrödinger and the QEF.

Read more on the Schrödinger website

Quantum ESPRESSO v.6.0

giannozz — Wed, 05 Oct 2016 20:49:06 +0000

Version 6.0 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here.

Quantum ESPRESSO v5.4.0

qewpadmin — Mon, 25 Apr 2016 21:10:37 +0000

Version 5.4.0 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here.

The Walter Kohn prize

qewpadmin — Sun, 31 Jan 2016 17:21:19 +0000

A prize for outstanding contributions in the field of quantum-mechanical materials and molecular modeling. More information here.

Quantum ESPRESSO v5.3.0

qewpadmin — Mon, 11 Jan 2016 20:21:57 +0000

Version 5.3.0 of Quantum ESPRESSO is available for download.

Quantum ESPRESSO v.5.2.1

spigafi — Thu, 24 Sep 2015 12:10:15 +0000

Version 5.2.1 of Quantum ESPRESSO is available for download.

Quantum ESPRESSO v.5.2.0

giannozz — Sat, 20 Jun 2015 15:49:09 +0000

Version 5.2.0 of Quantum ESPRESSO is available for download.

Quantum ESPRESSO v.5.1.2

giannozz — Mon, 09 Mar 2015 07:15:57 +0000

Version 5.1.2 of Quantum ESPRESSO is available for download.

2015 Developers’ Meeting

giannozz — Thu, 22 Jan 2015 14:52:07 +0000

Program of the 2015 developers meeting, held on 14th January 2014 in ICTP.

10:00-10:30 Paolo Giannozzi
Introduction, state of the art, achievements and non-achievements of 2014, plans for 2015 (slides)
10:30-10:50 Iurii Timrov
Update on on linear-response codes: TD-DFPT, EELS, PCM (slides)
11:00-11:20 Paolo Umari
BSE without conduction states, improved algorithms for hybrid functionals (slides)
11:30-11:50 Marco Govoni
New developments in GW and in hybrid functionals (slides)
12:00-12:30 Anton Kozhevnikov
Ongoing work at CSCS and the SIRIUS library (slides)

14:00-14:20 Fabio Affinito
Porting QE on Xeon Phi (slides: 1, 2)
14:30-14:50 Filippo Spiga
Status of QE-GPU; buildbot; testsuite (slides)
15:00-15:20 Andrea Cepellotti
Latest bews on AiiDA (slides)
15:30-15:50 Oliviero Andreussi
Status of Environ (slides)
15:50-16:00 Tone Kokalj
PWtk – a scripting interface for PWscf (slides)