Events

Sep
13
Sat
50th Symposium on Theoretical Chemistry @ University of Vienna
Sep 13 – Sep 18 all-day

The 50th Symposium on Theoretical Chemistry, will take place in Vienna, Austria from September 14-18, 2014.

This year meeting will feature 15 invited speakers, who will present talks spanning from the development of methods in quantum chemistry, in dynamics, or the combination of both, to applications, also for excited states and light-induced processes. Additionally, 24 oral presentations from any field of Theoretical Chemistry will be selected from submissions and posters. Two poster sessions will allow you to interact with theorists from all fields of Theoretical Chemistry. On September 17th, the Hellmann Prize will be awarded to a young theoretical chemist.

The 50th anniversary will be additionally celebrated with two historical lectures. Wilfried Meyer (Kaiserslautern) will highlight the development of Theoretical Chemistry in the last 50 years within the German speaking countries and Klaus Ruedenberg (Iowa) will tell us about the history of Chemistry starting 3000 years ago.

Important dates:

Registration is now open and closes on the 30th of May.

Abstract deadline for oral contributions: 15th June.

Abstract deadline for posters: 15th July.

The number of participants is limited, so we cordially invite you to register as soon as possible.  A contingent of affordable rooms have been reserved to facilitate housing in Vienna.  September is conference high season and cheap accommodation runs out fast. It is therefore recommended to book early. If you fly with Austrian airlines, a discount of 15% is applied for STC participants.

Jun
18
Thu
Spectroscopy Lectures :: theory and codes @ CECAM-HQ-EPFL
Jun 18 – Jun 19 all-day

The CECAM School on: “Theoretical Spectroscopy Lectures: theory and codes” reaches the 6th edition and takes place from 18th to 22th of May, 2015 at the CECAM-HQ-EPFL, Lausanne, Switzerland.

Electronic excitations are probed by experimental techniques such as optical absorption, EELS and photo-emission (direct or inverse). From the theory point of view, excitations and excited state properties are out of the reach of density-functional theory (DFT), which is a ground-state theory. In the last twenty years other ab-initio theories and frameworks, which are able to describe electronic excitations and spectroscopy, have become more and more used: time-dependent density-functional theory (TDDFT) and many-body perturbation theory (MBPT) or Green’s function theory (GW approximation and Bethe-Salpeter equation BSE). In fact, computational solutions and codes have been developed in order to implement these theories and to provide tools to calculate excited state  properties.The present school focuses on these points, covering theoretical, practical, and also numerical aspects of TDDFT and MBPT, and codes implementing them (ABINIT, DP, EXC).

The presentation of the theory will be followed by practical classes and hands-on  tutorials. At the end of the school, students will have sufficient working knowledge to  pursue their projects at their home institution. The participants are expected to have a fair knowledge of DFT prior to the school (see Ref. 1, given in the school’s website) and to be familiar with one plane-wave pseudopotential based software.
Indeed, although at the beginning of the school, we will make sure that the DFT level of all participants is enough in this respect and provide the needed complementary  information and training, the purpose of the school is to go beyond DFT, with hands-on exercices based on plane-wave implementations.

The deadline for application is on 15 April 2015, but giving the limited number of places (around 25) many applications will be considered even before the deadline. Especially student candidates coming from outside EU are encouraged to register soon: an answer to them will be given as soon as possible for VISA and traveling purposes.

In order to apply for the school, please go to: http://www.cecam.org/workshop-1136.html

Jul
12
Sun
FEMTO12 – The Hamburg Conference on Femtochemistry @ CFEL, CUI, DESY, and Universität Hamburg
Jul 12 @ 8:30 am – Jul 17 @ 9:30 am

The 12th Femtochemistry Conference (FEMTO12) – Frontiers of ultrafast phenomena in Chemistry, Biology, and Physics – will take place in Hamburg, Germany, from 12. to 17. July 2015. The venue will be the Campus Bahrenfeld of DESY and the University of Hamburg, which with its unique facilities and scientific environment provides a great scientific setting for this ultrafast science conference.

Hamburg, officially “Free and Hanseatic City of Hamburg”, is the second largest city in Germany and the eighth largest city in the European Union. The Hamburg Metropolitan Region has more than 5 million inhabitants. The port of Hamburg, on the river Elbe, is the second largest port in Europe (after the Port of Rotterdam) and tenth largest worldwide. Hamburg is a major transport hub and is one of the most affluent cities in Europe. The city is a notable tourist destination for both domestic and overseas visitors and it is ranked 17th in the world for livability in 2012. See, for instance, http://english.hamburg.de for more details on the city.

FEMTO12 will bring together scientists from all over the world to present and discuss the most recent advances in femtosciences, including reaction dynamics, coherent control, structural dynamics, solvation phenomena, liquids and interfaces, fast processes in biological systems, strong field processes, attosecond electron dynamics and aggregates, surfaces and solids with contributions from both theory and experiment.

Registration is open at http://www.femto12.org/registration, with a deadline of 30. April 2015 for abstract submission and early bird payment. A number of submitted abstracts will be selected for hot topics talks.

In order to allow as many early-stage researchers as possible to attend the conference, the Hamburg Center for Ultrafast Imaging provides substantial support for PhD students upon application. Please see http://www.femto12.org/registration for details. Moreover, a block of rooms is set aside in the DESY guest house especially for students participating in FEMTO12.

Further details regarding travel and housing are provided on the FEMTO12 website.

The confirmed invited speakers are listed at http://www.femto12.org/program/speaker and currently include

  • Bernd Abel (Universität Leibzig)
  • Philip Anfinrud (NIDDK, NIH, Bethesda, MD)
  • Huib Bakker (AMOLF, Amsterdam, The Netherlands)
  • Misha Bonn (MPI Polymer Research, Mainz)
  • Tobias Brixner (Universität Würzburg)
  • Francesca Calegari (Politecnico di Milano)
  • Martin Centurion (University of Nebraska)
  • Henry Chapman (CFEL, DESY and Universität Hamburg)
  • Majed Chergui (EPFL Lausanne)
  • Martina Dell’Angela (Elettra Sincrotrone Trieste)
  • Thomas Elsaesser (Max-Born-Institut, Berlin)
  • Fernando Martín García (Universidad Autonoma de Madrid)
  • Leticia González (Universität Wien)
  • Frank de Groot (University of Utrecht)
  • Kevin Kubarych (University of Michigan)
  • Damien Laage (ENS Paris)
  • Stefan Lochbrunner (Universität Rostock)
  • Jom Luiten (Technische Universiteit Eindhoven)
  • Dwayne Miller (CFEL, MPSD, Hamburg and University of Toronto)
  • Keith Nelson (MIT, Cambridge, MA)
  • Kenji Ohmori (Institute for Molecular Science, Okazaki)
  • Hrvoje Petek (University of Pittsburgh)
  • Arnaud Rouzée (Max-Born-Institut, Berlin)
  • Artem Rudenko (Kansas State University)
  • Tamar Seideman (Northwestern University, Evanston, IL)
  • Henrik Stapelfeldt (Aarhus University)
  • Villy Sundström (University of Lund)
  • Toshinori Suzuki (Kyoto University)
  • Regina de Vivie-Riedle (LMU München)
  • Peter Vöhringer (Rheinische Friedrich-Wilhelms-Universität Bonn)
  • Matthias Wollenhaupt (Carl von Ossietzky Universität Oldenburg)
  • Hans Jakob Wörner (ETH Zürich)
Jun
6
Tue
CECAM workshop Seeking synergy between dynamics and statistics for non-equilibrium quantum processes
Jun 6 – Jun 9 all-day

The CECAM workshop Seeking synergy between dynamics and statistics for non-equilibrium quantum processes will be held in Paris in June 6th-9th.

One of the major difficulties in achieving an accurate theoretical descriptions of non-equilibrium processes in quantum mechanical systems is framed by the desire to provide a representation of the system of interest that is as realistic as possible, in a manner that is computationally tractable. The coupling of electronic and nuclear motion involving excited states, the quantum nature of the nuclear degrees of freedom, and the application of time-dependent driving forces, are just few examples of the effects that must be addressed in order to simulate these processes. Each of these effects poses unique challenges to theoretical progress. A number of exact and approximate quantum dynamics techniques are being developed and refined in order to provide algorithms that respond to the demand for a balance between computational efficiency and physical accuracy. Currently available techniques are typically based upon two different, but equivalent, formulations of many-body quantum mechanics, the wave function approach or the density matrix picture.

The proposed workshop aims to bring together the two principal molecular quantum dynamics communities (wave-function methods and density matrix approaches). The scope is threefold, (i) to identify and explore common goals and obstacles, (ii) help in fostering new ideas to connect these approaches, and bridge the apparent gap between approximate dynamical and statistical descriptions, (iii) identify possible routes to extend dynamics approaches to the domain of statistics.

At the workshop, experts are asked to uncover the fundamental details of the methods in pedagogical lectures. These lectures will be followed by extensive discussions, during which contributed speakers and participants are welcome to put forth some of their doubts and problems in the relation between dynamics and statistics.

Further information can be at:          https://www.cecam.org/workshop-1483.html

Preliminary invited speakers are:

Nandini Ananth (Cornell University, USA) Sara Bonella (CECAM, Switzerland) Irene Burghardt (Goethe University, Germany) Eitan Geva (University of Michigan, USA) E. K. U. Gross (Max-Planck Institute of Microstructure Physics, Germany) Raymond Kapral (University of Toronto, Canada) Dvira Segal (University of Toronto, Canada) Jeremy Richardson (ETH Zurich, Switzerland) Graham Worth (University College London, UK)

Aug
12
Sat
FEMTO13 @ Marriott Resort Casamagna Cancun
Aug 12 – Aug 17 all-day

The Femtochemistry (FEMTO13) Conference will be dedicated to the Legacy of Professor Ahmed Zewail.

FEMTO13 will take place in Cancun, Mexico, from August 12th to 17th, 2017. At the conference there will be a Mini-Symposium of Zewail Alumi, and there will be a Mini-Symposium where The 6th Ahmed Zewail Prize in Molecular Sciences will be awarded to Professor Michael Grätzel from the Ecole Polytechnique Fédérale de Lausanne, Switzerland.

The venue will be the Marriott Resort Casamagna Cancun, located on the beach near Cancun city and not too far from the Maya city of Tulum.

We invite you to visit us @ http://femto13.unam.mx/ to explore our list of outstanding invited speakers and exciting scientific program.

Marcos Dantus and Jorge Peon

If you have any questions or you would like to see our first circular email  us directly at femto13@chemistry.msu.edu

Sep
4
Mon
11EUCO-TCC @ Institut d’Estudis Catalans (Institute for Catalan Studies, IEC)
Sep 4 – Sep 7 all-day
11EUCO-TCC @  Institut d’Estudis Catalans (Institute for Catalan Studies, IEC) | Barcelona | Catalonia | Spain

The local organizing committee of the Catalan Chemical Society (SCQ) cordially invites you, on behalf of the Division of Computational and Theoretical Chemistry (DCTC) of the European Association of Chemical and Molecular Sciences (EuCheMS), to participate at the 11th European Conference on Theoretical and Computational Chemistry, September 4 – September 7, 2017, in Barcelona.

The conference will reflect recent advances, developments and trends in the field and its impact on related molecular sciences and technology. EuCO-TCC 2017 will provide a unique information and communication platform and will cover a wide range of subjects related to computational chemistry, theoretical chemistry, material sciences, biology and drug design, and from fundamental academic research to industrial applications.

This invitation is addressed to scientists in academia, industry and in governmental institutions. You are all warmly welcomed to share your most recent findings and ideas and to continue the tradition of EuCO-CC conferences (Nancy 1994, Lisbon 1997, Budapest 2000, Assisi 2002, La Londe le Maures 2006, Tale 2006, Venetia 2008, Lund 2010, Sopron 2013, Fulda 2015).

Outstanding keynote speakers will outline recent trends in vary fields of interest. The scientific program will be completed by exhibitors presenting latest methods and applications in the field of computational chemistry.

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.

Jul
16
Mon
Symposium in Honour of Otilia Mó and Manuel Yáñez @ Campus Tecnológico Fábrica de Armas
Jul 16 all-day