August 9, 2021
Shear and Breathing Modes of Layered Materials
Layered materials (LMs), such as graphite, hexagonal boron nitride, and transition-metal...
August 3, 2021
Invariance principles in the theory and computation of transport coefficients
F. Grasselli and S. Baroni
August 3, 2021
Invariance principles in the theory and computation of transport coefficients
In this work, the authors elaborate on two recently discovered invariance principles, according to...
July 19, 2021
MaX codes: webinars, links, facts and figures - Booklet
Last year MaX Centre of Excellence organized a series of 7 webinars on the flagship codes (Quantum...
July 9, 2021
Data
M A X offers a materials informatics ecosystem for automated high-throughput calculations and the automatic storage of data in graph databases which is based on AiiDA as the working environment and on the Materials Cloud as the cloud simulation and web dissemination and sharing platform.
July 9, 2021
FAQs
List of pages of FAQs related to the MaX flagship codes and to the HPC facilities in the MaX consortium
July 9, 2021
Services to the Industry
MaX develops personalised consultancy to industries for specific and targeted needs. Discover how!
June 11, 2021
Compact atomic descriptors enable accurate predictions via linear models
C. Zeni, K. Rossi, A. Glielmo, and S. de Gironcoli
June 11, 2021
Compact atomic descriptors enable accurate predictions via linear models
The authors probe the accuracy of linear ridge regression employing a three-body local density...
May 27, 2021
Electronic-structure methods for materials design
Marzari, N., Ferretti, A. & Wolverton, C.
May 27, 2021
Electronic-structure methods for materials design
The accuracy and efficiency of electronic-structure methods to understand, predict and design the...
May 21, 2021
Optimizing Digital Teaching and Communication
In September 2021 we will hold a hands-on workshop on e-learning techniques and strategies, under...