News

  • 24.11.17

    Second Quantum ESPRESSO Manifesto published

    Eight years and 6000+ citations after the first Quantum ESPRESSO Manifesto was published, a new version is available (here in open access) thanks to the concerted effort of a team of 50 authors, coordinated by Paolo Giannozzi and Stefano Baroni.

  • 23.10.17

    Quantum ESPRESSO v.6.2

    Version 6.2 of Quantum ESPRESSO is available for download. You can find all archives uploaded on QE-FORGE here

  • 01.02.17

    Schrödinger extends Materials Science capabilities through integration with QE

    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

is an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modeling at the nanoscale. It is based on density-functional theory, plane waves, and pseudopotentials.