Session | ||
S26.07: Various Topics
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Presentations | ||
2:00pm - 2:20pm
A Quasi Time-Reversible Grassmann extrapolation of density matrices for accelerating Born-Oppenheimer molecular dynamics 1University of Pisa; 2École des Ponts ParisTech, France; 3Université de Franche-Comté, France; 4University of Stuttgart 2:20pm - 2:40pm
A Posteriori Error Analysis for Kohn-Sham Equations with Convex Exchange-Correlation Functionals University of Stuttgart 2:40pm - 3:00pm
Applying a Well-Defined Energy Density for Machine-Learned Density Functionals University of Fribourg, Switzerland 3:00pm - 3:20pm
Moreau-Yosida Regularization in Density-Functional Theory Oslo Metropolitan University |