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 ...
Version 6.0 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here.
Version 5.4.0 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here.
A prize for outstanding contributions in the field of quantum-mechanical materials and molecular modeling. More information here.
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 (