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BNL Software School for First Principles and Dyn ... (No replies)

Robert Konik
4 years ago
Robert Konik 4 years ago

We would like to announce a virtual school that Brookhaven National Laboratory's Computational Materials Science Center, Comscope, is running during the week of June 21:

https://www.bnl.gov/ccmssummerschool2021/

This school will provide an introduction including hands-on training to the software that the Center has been developing.  Two code packages will be taught that offer differing approaches to capturing the behavior of strongly correlated materials in a first principles framework.  The first, FlapwMBPT (Full-potential Linearized Augmented Plane Wave with Many Body Perturbation Theory) is a first principles code that permits computations going beyond the GW approximation including the computation of vertex corrections.  The second, Comsuite, is a software package that offers three different versions of dynamical mean field theory (DMFT) in a first principles framework: LDA+DMFT, GW+DMFT, and Rotationally Invariant Slave Bosons+LDA.

Registration is free and can be done at the website above. 

Instructors include:

Gabi Kotliar (Introduction to first principles DMFT)

Andrey Kutepov (FlapwMBPT)

Sangkook Choi (LDA+DMFT, GW+DMFT)

Nicola Lanata and Yong-Xin Yao (RISB+LDA)

 

 

 




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