Training & Collaboration

Newton-X is developed within an international community of researchers working on nonadiabatic dynamics, excited-state simulations, and related computational methods. We support training activities, research visits, and collaborative software development.

Training

Tutorials, workshops, and schools

Newton-X developers regularly contribute to workshops and schools on mixed quantum–classical dynamics, nonadiabatic molecular dynamics, and computational photochemistry.

Upcoming events

International Autumn School CP2K–Newton-X–Libra–WaveMixing for Mixed Classical–Quantum Dynamics
R. S. Mattos, R. Kar, M. Barbatti, and A. Hehn
Kiel, Germany, 14–16 October 2026

Past events

Workshop Molecules in Excited States — MolEx2025
S. Mukherjee, J. M. Toldo, and M. Barbatti
Toruń, Poland, 9–13 June 2025

École de Physique des Houches
J. M. Toldo
Les Houches, France, 27 July–1 September 2023

Winter School RFCT — Pôle Sud-Est 2020–2021
M. Pinheiro Jr. and P. Goel
Réseau Français de Chimie Théorique, online, 18–29 January 2021

Research visits in Marseille

Students and researchers interested in learning or applying Newton-X may contact us regarding a short research stay at Aix-Marseille University.

These visits must normally be supported by the visitor’s institution or another external source of funding. Before contacting us, prospective visitors should identify a scientific project, the Newton-X methods or modules they wish to use, the proposed duration of the stay, and a potential source of financial support.

Collaborations

Contributions extending the capabilities of Newton-X are welcome. Researchers planning to implement new methods, interfaces, analysis tools, or other features are encouraged to contact the development team at an early stage.

Early discussion can help to:

  • avoid duplication or conflicts with developments already in progress;
  • ensure compatibility with the Newton-X architecture and coding conventions;
  • identify opportunities for collaboration;
  • obtain scientific and technical guidance from experienced developers; and
  • facilitate testing, documentation, and eventual integration into an official release.

Both individual contributions and broader collaborative projects are welcome.