Events

May
14
Sun
CECAM School: Quantum and Mixed Quantum Classical Dynamics in photochemistry @ CECAM HQ
May 14 – May 18 all-day
CECAM School: Quantum and Mixed Quantum Classical Dynamics in photochemistry @ CECAM HQ | Lausanne | Vaud | Switzerland

Photoinitiated processes are not only important for understanding natural phenomena but they also play an undeniable role in the booming fields of renewable energy, material design and medicine. Excited state processes have traditionally been explained from a static point of view, delivering in some cases a biased, incorrect or even incomplete description of the former. The simulation of the dynamics of such processes is therefore fundamental for the quest to understand the chemical and physical mechanisms.
The purpose of this school is to introduce its participants to state-of-the-art methodologies for the simulation of the dynamics of processes in the excited state, following the evolution in time of photoinitiated reactions, one of the priority topics of this call.

The school will be focused in simulating the dynamics of complex molecules. Electronic ab initio or TD-DFT methods would be sketched for obtaining the electronic wavefunctions or densities, that would be afterwards quantum-mechanically propagated. Moreover, several approaches for the treatment of the nuclei will be also provided, from full quantum dynamics to mixed quantum-classical dynamics.

The course is directed at PhD students, and young researchers, beginners in the field, working in theoretical chemistry and molecular physics.

More information at: https://www.cecam.org/workshop-1542.html

May
25
Thu
MACUMB 2017 @ Facultad de Ciencias, Universidad Autonoma de Madrid
May 25 – May 26 all-day
MACUMB 2017 @ Facultad de Ciencias, Universidad Autonoma de Madrid | Madrid | Community of Madrid | Spain

The scientific workshop: “Massive Computation for Ultrafast Molecular Breaking” (MACUMB 2017) will be held in the Universidad Autónoma de Madrid (Spain) on 25th and 26th of May 2017.

The scientific program (http://www.macumb.info/programme.html) includes ten invited talks that will be combined with two 3-hours practical sessions in computer rooms. We aim to bring together developers of the state-of-the-art scientific software in the field of quantum chemistry and molecular physics.

Registration is already open and closes on May 15th, 2017. The registration for the meeting is free for all participants.

You can find detailed information at http://www.macumb.info/

Organizers:
Alicia Palacios, Sergio Díaz-Tendero and Jesús González-Vázquez
Departamento de Química, Facultad de Ciencias
Universidad Autónoma de Madrid

Jul
23
Sun
ISIAC and (e,2e)-pol satellites to ICPEAC
Jul 23 – Aug 4 all-day

The two ICPEAC satellite meetings:

still welcome abstract submissions until the end of April. The confirmed invited speakers are available at the respective Scientific Program links.

We look forward to your participation,

Alisher Kadyrov, Chair of ISIAC

Igor Bray, Chair of (e,2e)-pol

Jul
2
Mon
CECAM workshop: Non-adiabatic quantum dynamics: From Theory to Experiments @ CECAM HQ
Jul 2 – Jul 6 all-day

The CECAM workshop entitled ‘Non-adiabatic quantum dynamics: From Theory to Experiments’ (https://www.cecam.org/workshop-0-1638.html) will be held at CECAM HQ in Lausanne, Switzerland from 2nd-6th July 2018.

This workshop aims to consolidate the rapid development in the field of molecular quantum dynamics and increase the synergy between experimentalists and theoreticians in this area. The program features a number of invited presentations from leading theoreticians and experimentalists and will be supplemented by a number of talks selected from submitted abstracts.

We are looking forward to welcoming you to Lausanne.

Tom Penfold on behalf of all of the co-organisers.