Category: news

AiiDA tutorial @CINECA

Great success for the last AiiDA tutorial, sponsored by PRACE and the H2020 MaX Centre of Excellence, organized in collaboration with the Italian CINECA supercomputer centre, who hosted the event from May 29 and June 1, 2018, in bologna (Italy). More than twenty participants, with a

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An ICN2- HR – MaX course on Siesta is open for subscription

SPIN-ORBIT COUPLING IN SIESTA: MAGNETISM AND OTHER CAPABILITIES 20 – 22 June 2018,  ICN2 SEMINAR HALL, ICN2 BUILDING, UAB, Barcelona (ES) ICN2 OPEN KNOWLEDGE PROGRAM – MODULE 8 By Dr Ramón Cuadrado, Theory and Simulation Group, ICN2. This course will outline how

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Koopmans-Compliant Spectral Functionals for Extended Systems: a new scientific article from the MaX team

Published on Wednesday a new scientific article by Ngoc Linh Nguyen, Nicola Colonna (Theory and Simulations of Materials – THEOS, and National Centre for Computational Design and Discovery of Novel Materials – MARVEL, École Polytechnique Fédérale de Lausanne – EPFL) with

HPC nano workshop

Prof. Elisa Molinari, director of the MaX Centre of Excellence, will be one of the keynote speakers at the High Performance Computing for Next Generation Nanomaterials & Nanodevices Engineering Workshop. She will give a take about “Materials design at the exascale”.

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New materials to rethink the world: prof. N. Marzari explains what new materials are all about

May is full of  public events involving Prof. Nicola Marzari (EPFL – Marvel), one of the principal investigators of MaX Centre of Excellence. Save the dates! May 7  Rome (IT), for a public speech in Teatro Eliseo on quantum simulation,

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Quantum ESPRESSO software developer: open position

The Quantum ESPRESSO Foundation will fund a scientific software developer position, initially for one year and renewable up to three times depending upon the availability of funding. The work will take place under the supervision of Prof. Paolo Giannozzi at

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PRACE-MaX tutorial @CINECA: the deadline for the registration is approaching!

AiiDA is a flexible and scalable informatics’ infrastructure to manage, preserve, and disseminate the simulations, data, and workflows of modern-day computational science. The PRACE–MaX tutorial is targeted at about 40 students, postdocs and researchers interested in applying high-throughput computations in their research,

Quantum-Espresso Workshop 2018

The Materials Computation Center of the Materials Research Institute at Pennsylvania State University announces the 2018 Quantum-Espresso Workshop.  The workshop will be held at the Pennsylvania State University (University Park, PA USA) from May 21 to May 25, 2018. Quantum-Espresso

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AiiDA release v0.11.3

A new AiiDA release v0.11.3 is now available! You can find more information at our download page. A detailed overview of a all the changes can be found in the change log on GitHub.

Just published a new work

Just published online the new work on “Ferromagnetic and antiferromagnetic coupling of spin molecular interfaces” by the CNR Nano researchers involved in MaX CoE, the University of Rome “La Sapienza”, and ALBA Synchrotron Light Source, Barcelona. More info on Nano Letters