eSSENCE-EMMC Meeting 2022

Welcome to the eSSENCE-EMMC Meeting

"Multiscale modelling of materials and molecules 2022"

Detailed conference program click here.

Overview conference program click here.

All abstracts (keynote, invited, contributed orals, and posters): click here

The conference dinner (for those who signed up) is at Le Parc Restaurant, see map here

Telephone numbers to Taxi companies: Taxi Kurir 018-123 456; Uppsala Taxi 018-100 000.

Time: Wednesday 1 June (13:00 CEST) - Friday 3 June (ca. 12.30 CEST)

Venue: This is an on-site meeting at the Ångström Laboratory, Uppsala University in the Lecture hall Sonja Lyttkens on the 1st floor in the new Ångström building ("House 10"). Hybrid facilities are not provided.

Invited keynote lectures

• Gábor Csányi (University of Cambridge, UK) "First principles force fields"

• Stefaan Cottenier (University of Ghent, BE) "Testing the hell out of DFT codes with virtual oxides"

• Ansgar Schäfer (BASF, DE) "Why BASF invests in atomistic modelling"

• Lilit Axner (EuroCC National Competence Centers) "Exascale computing, EuroCC and the HPC future"

• Erik Lindahl (Stockholm Univ, SE) "Strategies for spatial and temporal multiscale models of complex molecules with molecular dynamics"

Invited talks

• Biplab Sanyal (Physics, UU) "DFT to tight-binding and beyond"

• Konstantin Neyman (Physics, Univ of Barcelona) "Ordering in bimetallic nanoparticles: Effects of environment"

• Bo Durbeej (Chemistry, Linköping Univ) "Multiscale Modelling in Photophysics: resolving a tricky fluorescence case in polar solution"

Conference themes

Multiscale modelling (coupling & linking of models) is a central theme in computer simulations/calculations and it is also a central theme of this meeting. We will use the term multiscale in an open and inclusive sense at this meeting.

There will be dedicated presentations on:

• Methods, models, codes

• Multiscale modelling

• Physics-based or/and data-driven

• Batteries and energy materials

• Molecules and molecular systems

• Exciting modelling applications

• Industry—academia barriers

• And more ...

Information about Hotels and Travelling

Go to "Where to go?" in the Menu bar

Support and context

This meeting is arranged within the Swedish national strategic e-science research programme eSSENCE in collaboration with the European Materials Modelling Council (EMMC) and with colleagues from our sister programme SeRC.

The meeting is supported by:

and is arranged in co-operation with:

Previous information:

Oral and poster contributions are very welcome!

Academic and industrial participants are equally welcome.

Registration: Deadline is Friday 20 May*. (See Registration in the Menu above)

Submit an oral/poster contribution: Deadline Friday 20 May*. (See Abstract submission in the Menu above).

Want an oral poster-minipresentation? Poster presenters are offered a 3-minute oral minipresentation.

No conference fee: The meeting is free of charge (incl all meals and conference dinner)

*Change made 20 May: We will accept registrations and contributions until the evening of Monday 23 May at 18 CEST.