Total Energy and Force — Workshop on Computational Physics and Material Science

The main objective of this event is to identify new developments and topics in the field of electronic-structure methods from the first-principles perspective, their diverse applications, and its mathematical foundations. As such, it provides a great opportunity to assemble a wide range of leading scientists working on different aspects of computational material science.

Topics: Density-functional theory beyond LDA, time-dependent DFT, manybody techniques for real materials, quantum Monte Carlo, ab-initio molecular dynamics, electron-phonon coupling, large scale and multiscale simulations, activated processes, electronic transport, response to external fields, simulations in realistic environments