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The Bases of Chemical Thermodynamics, Volume 2

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First-principles thermodynamics of precipitation in aluminum-containing refractory alloys

Anirudh Raju Natarajan

Materials for high -temperature environments are actively being investigated for deployment in aerospace and nuclear applications. This study uses computational approaches to unravel the crystallography and thermodynamics of a promising class of refractory ...

Pergamon-Elsevier Science Ltd2024

Soliton gas: Theory, numerics, and experiments

The concept of soliton gas was introduced in 1971 by Zakharov as an infinite collection of weakly interacting solitons in the framework of Korteweg-de Vries (KdV) equation. In this theoretical construction of a diluted (rarefied) soliton gas, solitons with ...

Amer Physical Soc2024

Advances in hydration and thermodynamics of cementitious systems

Karen Scrivener, Patrick Juilland, Aslam Kunhi Mohamed, Fabien Jacques Michel Georget, Thomas Matschei

Optimising the hydration of cementitious materials is crucial to leverage their full potential and avoid wasting resources, embodied energy and CO2. Understanding the fundamental mechanisms is key to reach these objectives. In this paper, we review progres ...

Oxford2023

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 ...

NATL ACAD SCIENCES2022

High-Throughput Sizing, Counting, and Elemental Analysis of Anisotropic Multimetallic Nanoparticles with Single-Particle Inductively Coupled Plasma Mass Spectrometry

Andreas Züttel, Natalia Gasilova, Cedric David Koolen, Wen Luo, Mo Li, Ayush Agarwal

Nanoparticles (NPs) have wide applications in physical and chemical processes, and their individual properties (e.g., shape, size, and composition) and ensemble properties (e.g., distribution and homogeneity) can significantly affect the performance. Howev ...

2022

Unlocking crowding by ensemble statistics

Michael Herzog, David Pascucci, Oh-Hyeon Choung, Yury Markov, Natalia Tiurina

In crowding,1-7 objects that can be easily recognized in isolation appear jumbled when surrounded by other elements.8 Traditionally, crowding is explained by local pooling mechanisms,3,6,9-15 but many findings have shown that the global configuration of th ...

CELL PRESS2022

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The exclusive presence of beta -D-ribofuranose in nucleic acids is still a conundrum in prebiotic chemistry, given that pyranose species are substantially more stable at equilibrium. However, a precise characterisation of the relative furanose/pyranose fra ...

NATURE RESEARCH2021

Le musée de Cluny est le musée national du Moyen Âge situé au cœur de Paris. Le site est composé d’un ensemble de bâtiments de différentes époques, dont deux monuments historiques : les thermes gallo-romains du Nord et l’hôtel médiéval des abbés de Cluny, ...

2021

"La cathédrale": un monument ferroviaire au coeur du développement urbain de Bellizona

Enrico Margaroli

Situé au cœur de la ville de Bellinzona, le site ferroviaire des ateliers CFF constitue une étape importante dans le développement urbain futur de la ville. Le site imposant, intimement lié au développement de la ligne du Saint-Gothard depuis plus d’un siè ...

2021

When looking at the city and the land, current architectural practices face a double limitation. On the one hand, the discipline is asked to react to its own specter: the body of authoritarian spatial devices based on a questionable tradition of which the ...

EPFL2021