Molecular Simulation at CECAM: Celebrating 50 Years
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Covers the basics of Density Functional Theory, challenges in DFT, and improvements in functional approximations and corrections for accurate calculations.
Explores Generalized Langevin Equations and their computational implications in molecular dynamics simulations, emphasizing the impact of noise details on particle trajectories.
Covers the precursors of Kohn-Sham Density Functional Theory (DFT) and the Kohn-Sham formulation, explaining types of Exc[p] approximations and the performance of LDA.
Explores the symbiotic relationship between neuroscience and information technology, emphasizing the need for new computational paradigms and innovative applications.
Delves into the challenges of regulating emerging technologies, focusing on AI and proposing a computational-philosophical approach to international law.
