Publications associées à Quantum statistical mechanics

Frustrated magnets in the limit of infinite dimensions: Dynamics and disorder-free glass transition

We study the statistical mechanics and the equilibrium dynamics of a system of classical Heisenberg spins with frustrated interactions on a d -dimensional simple hypercubic lattice, in the limit of infinite dimensionality d -> infinity . In the analysis we ...

Amer Physical Soc2024

Landscapes of DNA Mechanics and Genomes

Thomas Antonin Zwahlen

The local physical properties - such as shape and flexibility - of the DNA double-helix is today widely believed to be influenced by nucleic acid sequence in a non-trivial way. Furthermore, there is strong evidence that these properties play a role in many ...

EPFL2023

2023 Roadmap on molecular modelling of electrochemical energy materials

Alfredo Pasquarello, Chunmin Zhang, Assil Bouzid

New materials for electrochemical energy storage and conversion are the key to the electrification and sustainable development of our modern societies. Molecular modelling based on the principles of quantum mechanics and statistical mechanics as well as em ...

Iop Publishing Ltd2023

A complete description of thermodynamic stabilities of molecular crystals

Venkat Kapil, Edgar Albert Engel

Predictions of relative stabilities of (competing) molecular crystals are of great technological relevance, most notably for the pharmaceutical industry. However, they present a long-standing challenge for modeling, as often minuscule free energy differenc ...

National Academy of Sciences2022

Statistical limits of dictionary learning: Random matrix theory and the spectral replica method

Nicolas Macris, Jean François Emmanuel Barbier

We consider increasingly complex models of matrix denoising and dictionary learning in the Bayes-optimal setting, in the challenging regime where the matrices to infer have a rank growing linearly with the system size. This is in contrast with most existin ...

AMER PHYSICAL SOC2022

Structure-preserving approaches and data-driven closure modeling for model order reduction

Nicolò Ripamonti

In this thesis, we propose model order reduction techniques for high-dimensional PDEs that preserve structures of the original problems and develop a closure modeling framework leveraging the Mori-Zwanzig formalism and recurrent neural networks. Since high ...

EPFL2022

Conformal Field Theory at the Lattice Level: Discrete Complex Analysis and Virasoro Structure

Clément Hongler

Critical statistical mechanics and Conformal Field Theory (CFT) are conjecturally connected since the seminal work of Beliavin et al. (Nucl Phys B 241(2):333-380, 1984). Both exhibit exactly solvable structures in two dimensions. A long-standing question ( ...

SPRINGER2022

Perimeter Modes of Nanomechanical Resonators Exhibit Quality Factors Exceeding 10(9) at Room Temperature

Tobias Kippenberg, Alberto Beccari, Amirali Arabmoheghi, Nils Johan Engelsen, Guanhao Huang, Sergey Fedorov

Systems with low mechanical dissipation are extensively used in precision measurements such as gravitational wave detection, atomic force microscopy, and quantum control of mechanical oscillators via optomechanics and electromechanics. The mechanical quali ...

American Physical Society2022

Observation of SQUID-Like Behavior in Fiber Laser with Intra-Cavity Epsilon-Near-Zero Effect

Camille Sophie Brès, Jiaye Wu, Marco Clementi, Qian Li, Xuanyi Liu

Establishing relations between fundamental effects in far-flung areas of physics is a subject of great interest in the current research. Realization of a novel photonic system akin to the radio-frequency superconducting quantum interference device (RF-SQUI ...

WILEY-V C H VERLAG GMBH2022

Atomic subgraphs and the statistical mechanics of networks

Sofia Charlotta Olhede

We develop random graph models where graphs are generated by connecting not only pairs of vertices by edges, but also larger subsets of vertices by copies of small atomic subgraphs of arbitrary topology. This allows for the generation of graphs with extens ...

2021

Charge fluctuations from molecular simulations in the constant-potential ensemble

Sara Bonella, Alessandro Coretti

We revisit the statistical mechanics of charge fluctuations in capacitors. In constant-potential classical molecular simulations, the atomic charges of electrode atoms are treated as additional degrees of freedom which evolve in time so as to satisfy the c ...

2020

Adiabatic motion and statistical mechanics via mass-zero constrained dynamics

Sara Bonella, Alessandro Coretti

In recent work [Coretti et al., J. Chem. Phys., 2018, 149, 191102], a new algorithm to solve numerically the dynamics of the shell model for polarization was presented. The approach, broadly applicable to systems involving adiabatically separated dynamical ...

2020

Nuclear Quantum Effects: Fast and Accurate

Venkat Kapil

Atomistic simulations are a bottom up approach that predict properties of materials by modelling the quantum mechanical behaviour of all electrons and nuclei present in a system. These simulations, however, routinely assume nuclei to be classical particles ...

EPFL2020

Phase retrieval in high dimensions: Statistical and computational phase transitions

Florent Gérard Krzakala, Lenka Zdeborová, Bruno Loureiro, Bruno Loureiro

We consider the phase retrieval problem of reconstructing a n -dimensional real or complex signal X ⋆ from m (possibly noisy) observations Y μ = | ∑ n i = 1 Φ μ i X ⋆ i / √ n | , for a large class of correlated real and complex random sensing matrices Φ , ...

Curran Associates, Inc.2020

Mechanical resonators with high dissipation dilution in precision and quantum measurements

Sergey Fedorov

Position measurements of mechanical oscillators underpin experiments spanning from applied nanoscale sensing to endeavors aiming to resolve open fundamental problems of modern physics. Sufficiently precise position measurements are also used for engineerin ...

EPFL2021

Quantifying high-order interdependencies via multivariate extensions of the mutual information

Michael Christoph Gastpar, Fernando Rosas de Andraca

This paper introduces a model-agnostic approach to study statistical synergy, a form of emergence in which patterns at large scales are not traceable from lower scales. Our framework leverages various multivariate extensions of Shannon's mutual information ...

2019

Topological exploration of artificial neuronal network dynamics

Kathryn Hess Bellwald, Gard Spreemann

One of the paramount challenges in neuroscience is to understand the dynamics of individual neurons and how they give rise to network dynamics when interconnected. Historically, researchers have resorted to graph theory, statistics, and statistical mechani ...

2019

Anomalous Effects of Velocity Rescaling Algorithms: The Flying Ice Cube Effect Revisited

Berend Smit, Seyedmohamad Moosavi, Efrem Daniel Braun

The flying ice cube effect is a molecular dynamics simulation artifact in which the use of velocity rescaling thermostats sometimes causes violation of the equipartition theorem, affecting both structural and dynamic properties. The reason for this artifac ...

2018

Molecular phenomena in organic aerosol: water interaction

Gözde Bitlislioglu

There is still lack of knowledge about the aerosols physics and chemistry and consequently their impact on climate and health. The complexity of involved chemical interactions makes the characterization of these particles with experimental studies challeng ...

EPFL2018

High-Dimensional Inference on Dense Graphs with Applications to Coding Theory and Machine Learning

Mohamad Baker Dia

We are living in the era of "Big Data", an era characterized by a voluminous amount of available data. Such amount is mainly due to the continuing advances in the computational capabilities for capturing, storing, transmitting and processing data. However, ...

EPFL2018