The exact factorization part II: Molecular Berry phases and the ab-initio description of phonon-mediated superconductivity

Eberhard K.U. Gross, Fritz Haber Center Institute of Chemistry, Israel

Thursday, October 28,  2021, 11 AM, Los Angeles Seminar Room

Abstract

The exact factorization part I: Non-adiabatic molecular dynamic

Eberhard K.U. Gross, Fritz Haber Center Institute of Chemistry, Israel

Thursday, October 14,  2021 at 11 AM at Casali 253

Abstract

Nanoscale Silicate Stardust: Astrochemical Relevance and Observational Signatures

Stefan T. Bromley, Institute of Theoretical and Computational Chemistry, University of Barcelona, Spain

Abstract

Encoding quantum-chemical knowledge into machine-learning models

Clemence Corminboeuf, EPFL, Switzerland

Abstract

Spectral properties of molecules and solids from Koopmans-compliant functionals

Nicola Colonna, Paul Scherrer Institut, Switzerland

Abstract

Unmasked - Open Quantum Systems in the Golan

The Fascinating Frictional Properties of Layered Materials

Oded Hod, School of Chemistry, Tel Aviv University

Abstract

On Electrons and Machine Learning Force Fields

Alexandre Tkatchenko, University of Luxembourg

Abstract

Graph theory and the rovibrational energies of molecules

Attila G. Császár, Institute of Chemistry, ELTE Eötvös Loránd University, Budapest Hungary

Abstract