Publications associées à Multithermal-Multibaric Molecular Simulations from a Variational Principle

Publications associées (31)

Sense in Motion with Belief Clustering: Efficient Gas Source Localization with Mobile Robots

Given the patchy nature of gas plumes and the slow response of conventional gas sensors, the use of mobile robots for Gas Source Localization (GSL) tasks presents significant challenges. These aspects increase the difficulties in obtaining gas measurements ...

2024

Thermal transport of glasses via machine learning driven simulations

Federico Grasselli, Paolo Pegolo

Accessing the thermal transport properties of glasses is a major issue for the design of production strategies of glass industry, as well as for the plethora of applications and devices where glasses are employed. From the computational standpoint, the che ...

Frontiers Media Sa2024

How Reproducible is the Synthesis of Zr-Porphyrin Metal-Organic Frameworks? An Interlaboratory Study

Wendy Lee Queen, Jocelyn Richard Roth

Metal-organic frameworks (MOFs) are a rapidly growing class of materials that offer great promise in various applications. However, the synthesis remains challenging: for example, a range of crystal structures can often be accessed from the same building b ...

Wiley-V C H Verlag Gmbh2024

A Study on Gradient-based Meta-learning for Robust Deep Digital Twins

Olga Fink, Raffael Pascal Theiler, Michele Viscione

Deep-learning-based digital twins (DDT) are a promising tool for data-driven system health management because they can be trained directly on operational data. A major challenge for efficient training however is that industrial datasets remain unlabeled. T ...

Research Publishing2023

Dated: Guidelines for Creating Synthetic Datasets for Engineering Design Applications

Jürg Alexander Schiffmann, Cyril Picard

Exploiting the recent advancements in artificial intelligence, showcased by ChatGPT and DALL-E, in real-world applications necessitates vast, domain-specific, and publicly accessible datasets. Unfortunately, the scarcity of such datasets poses a significan ...

Amer Soc Mechanical Engineers2023

Eight-vertex criticality in the interacting Kitaev chain

Frédéric Mila, Natalia Chepiga

We show that including pairing and repulsion into the description of one-dimensional spinless fermions, as in the domain wall theory of commensurate melting or the interacting Kitaev chain, leads, for strong enough repulsion, to a line of critical points i ...

AMER PHYSICAL SOC2023

Center-aware Adversarial Augmentation for Single Domain Generalization

Mathieu Salzmann

Domain generalization (DG) aims to learn a model from multiple training (i.e., source) domains that can generalize well to the unseen test (i.e., target) data coming from a different distribution. Single domain generalization (SingleDG) has recently emerge ...

IEEE COMPUTER SOC2023

Comparison of two methods for bioaerosol sampling and characterization in a low-biomass chamber environment

Dusan Licina, Shen Yang, Marouane Merizak

Bioaerosols are emitted from various sources into the indoor environment and can positively and negatively impact human health. Humans are the major source of bioaerosol emissions indoors, specifically for bacteria. However, efficient sampling to guarantee ...

PERGAMON-ELSEVIER SCIENCE LTD2023

Growth and investigation of Argon thin films adsorbed on graphite by means of Ultrafast Electron Diffraction

Paolo Usai

Starting from our big universe to the microscopic world, phase transitions play an important role in nature. Just after the Big Bang our universe experienced multiple phase transitions, from high-temperature plasma to the matter we know today. Phase transi ...

EPFL2023

Critical properties of the quantum Ashkin-Teller chain with chiral perturbations

Frédéric Mila, Natalia Chepiga

We investigate the nature of the phase transitions in the quantum Ashkin-Teller chain in the presence of chiral perturbations. We locate the Lifshitz line separating a region of direct chiral transitions from the region where the transition is through an i ...

Amer Physical Soc2023

Twisting instabilities in elastic ribbons with inhomogeneous pre-stress: A macroscopic analog of thermodynamic phase transition

Pedro Miguel Nunes Pereira de Almeida Reis, Michael Christopher Gomez

We study elastic ribbons subject to large, tensile pre-stress confined to a central region within the cross-section. These ribbons can buckle spontaneously to form helical shapes, featuring regions of alternating chirality (phases) that are separated by so ...

PERGAMON-ELSEVIER SCIENCE LTD2023

Stop Wasting my FLOPS: Improving the Efficiency of Deep Learning Models

Angelos Katharopoulos

Deep neural networks have completely revolutionized the field of machine learning by achieving state-of-the-art results on various tasks ranging from computer vision to protein folding. However, their application is hindered by their large computational an ...

EPFL2022

Customized Neural Network training to predict the highly imbalanced data of domestic hot water usage

Dolaana Khovalyg, Amirreza Heidari

Despite space heating and cooling, the energy use for hot water production has not changed significantly over time and accounts for a big share in modern, well-insulated buildings. The main challenge of hot water generation lies in the highly stochastic na ...

CLIMA 2022 conference2022

A neural probe to sample brain fluid in nanoliter volumes for quantitative molecular studies

Joan Teixidor

Neural functions operate in tightly controlled conditions that are mediated by multiple electrical and chemical phenomena. Brain disorders such as Parkinson's Disease and Alzheimer's Disease perturb these conditions and cause a loss of neurons, which impai ...

EPFL2022

Asynchrony Increases Efficiency: Time Encoding of Videos and Low-Rank Signals

Martin Vetterli, Adam James Scholefield, Karen Adam

In event-based sensing, many sensors independently and asynchronously emit events when there is a change in their input. Event-based sensing can present significant improvements in power efficiency when compared to traditional sampling, because (1) the out ...

IEEE-INST ELECTRICAL ELECTRONICS ENGINEERS INC2022

Equivariant Diffusion for Molecule Generation in 3D

Clément Arthur Yvon Vignac

This work introduces a diffusion model for molecule generation in 3D that is equivariant to Euclidean transformations. Our E(3) Equivariant Diffusion Model (EDM) learns to denoise a diffusion process with an equivariant network that jointly operates on bot ...

JMLR-JOURNAL MACHINE LEARNING RESEARCH2022

Virtual metrology applied to milling process

Paul Arthur Adrien Pierre Dreyfus

Production quality and process efficiency are the two main drivers that lead any industrial strategy. To ensure product quality, a duality historically existed between two approaches, namely batch sampling and systematic sampling. In batch sampling, the ba ...

EPFL2022

Mechanical intelligence for learning embodied sensor-object relationships

Ahalya Prabhakar

Intelligence involves processing sensory experiences into representations useful for prediction. Understanding sensory experiences and building these contextual representations without prior knowledge of sensor models and environment is a challenging unsup ...

Nature Portfolio2022

Tensor network investigation of the hard-square model

Frédéric Mila, Samuel Louis Nyckees

Using the corner-transfer matrix renormalization group to contract the tensor network that describes its partition function, we investigate the nature of the phase transitions of the hard-square model, one of the exactly solved models of statistical physic ...

AMER PHYSICAL SOC2022

Characterization of water sorption cycle in the cement microstructure of controlled oxide composition

Monisha Rastogi

This thesis investigates the water vapour sorption behaviour of samples with maximized calcium-silicate-hydrate (C-S-H) content. Primarily, the role of heterogeneous and homogeneous cavitation has been studied during the drying of cementitious materials. C ...

EPFL2022