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CECAM/Psi-k Workshop on “Electronic Structure ... (No replies)

k_reuter
9 years ago
k_reuter 9 years ago

Dear Psi-kers,

We gladly announce the CECAM/Psi-k workshop on “Electronic Structure Theory with Numeric Atom-Centered Basis Functions” to be held on July 20-22, 2016, at the TU Munich (Germany).

The workshop focuses on methods that leverage localized, numeric atom-centered orbital (NAO) basis functions, a choice upon which a number of the strongest available electronic structure developments are founded. The proposed workshop brings together key players from the FHI-aims code and related European and international efforts to highlight, discuss, and advance the state of the art of NAO-based modeling molecules and materials based on the first principles of quantum mechanics.

More information on the workshop can be found at

http://th.fhi-berlin.mpg.de/meetings/FHI-aims-2016/index.php?n=Meeting.Home ,

together with instructions to register.

We hope to see you in Munich!

Carsten Baldauf, Volker Blum, Matthias Scheffler, and Karsten Reuter




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Ab initio (from electronic structure) calculation of complex processes in materials