Publication

Efficient geometric integrators for nonadiabatic quantum dynamics. II. The diabatic representation

Related publications (31)

Enhancement of brain atlases with region-specific coordinate systems: flatmaps and barrel column annotations

Felix Schürmann, Juan Bautista Hernando Vieites, Michael Reimann, Huanxiang Lu, Armando Romani, Sirio Bolaños Puchet, Aleksandra Zuzanna Teska

Digital brain atlases define a hierarchy of brain regions and their locations in three-dimensional space. They provide a standard coordinate system in which diverse datasets can be integrated for visualization and analysis. They also enable building of dat ...

2024

Stochastic adaptive resampling for the estimation of discrete choice models

Michel Bierlaire, Nicola Marco Ortelli, Matthieu Marie Cochon de Lapparent

In the field of choice modeling, the availability of ever-larger datasets has the potential to significantly expand our understanding of human behavior, but this prospect is limited by the poor scalability of discrete choice models (DCMs): as sample sizes ...

2023

A multi scale consolidation model for press moulding of hybrid textiles into complex geometries

Vincent Werlen

Side-by-side hybrid textiles are an intermediate step for the production of fibre-reinforced thermoplastic composites. Press moulding these materials combining reinforcing fibre textiles and thermoplastic matrix textiles or flexible layers is a promising m ...

EPFL2023

Adaptive Symplectic Model Order Reduction Of Parametric Particle-Based Vlasov-Poisson Equation

Cecilia Pagliantini, Jan Sickmann Hesthaven, Nicolò Ripamonti

. High-resolution simulations of particle-based kinetic plasma models typically require a high number of particles and thus often become computationally intractable. This is exacerbated in multi-query simulations, where the problem depends on a set of para ...

AMER MATHEMATICAL SOC2023

Light-Induced Halide Segregation in 2D and Quasi-2D Mixed-Halide Perovskites

Manuel Cordova, David Lyndon Emsley, Aditya Mishra, Michael Allan Hope

Photoinduced halide segregation hinders widespread application of three-dimensional (3D) mixed-halide perovskites. Much less is known about this phenomenon in lower-dimensional systems. Here, we study photoinduced halide segregation in lower-dimensional mi ...

AMER CHEMICAL SOC2023

Laterally unconfined neutral or negative buoyancy inflow into a quiescent ambient over sloping bottom

Haoran Shi

This work studies the nearshore hydrodynamics of a shallow turbulent flow entering a laterally unconfined quiescent ambient with a sloping bottom boundary. Examples of such flow are neutrally buoyant ebb tidal jets and hyperpycnal river plumes entering ope ...

EPFL2023

Euclid: modelling massive neutrinos in cosmology a code comparison

Georges Meylan, Richard Massey, Bo Li, Yi Wang

The measurement of the absolute neutrino mass scale from cosmological largescale clustering data is one of the key science goals of the Euclid mission. Such a measurement relies on precise modelling of the impact of neutrinos on structure formation, which ...

Iop Publishing Ltd2023

Arithmetic and geometric deformations of threefolds

Fabio Bernasconi, Stefano Filipazzi

We show that mixed-characteristic and equicharacteristic small deformations of 3-dimensional canonical (resp., terminal) singularities with perfect residue field of characteristic p>5 are canonical (resp., terminal). We discuss applications to arithmetic a ...

Wiley2023

On the symmetries in the dynamics of wide two-layer neural networks

Lénaïc Chizat

We consider the idealized setting of gradient flow on the population risk for infinitely wide two-layer ReLU neural networks (without bias), and study the effect of symmetries on the learned parameters and predictors. We first describe a general class of s ...

AMER INST MATHEMATICAL SCIENCES-AIMS2023

Efficient geometric integrators for the linear and nonlinear time-dependent Schrödinger equation

Julien Roulet

Many physical and chemical reactions are driven by nonadiabatic processes, which imply the breakdown of the celebrated Born-Oppenheimer approximation. To understand these processes, experimentalists employ spectroscopic techniques. However, the obtained re ...

EPFL2022

Reduced basis methods for numerical room acoustic simulations with parametrized boundaries

Jan Sickmann Hesthaven, Hermes Sampedro Llopis

The use of model-based numerical simulations of wave propagation in rooms for engineering applications requires that acoustic conditions for multiple parameters are evaluated iteratively, which is computationally expensive. We present a reduced basis metho ...

ACOUSTICAL SOC AMER AMER INST PHYSICS2022