Thermodynamic properties of average-atom interatomic potentials for alloys
Graph Chatbot
Chat with Graph Search
Ask any question about EPFL courses, lectures, exercises, research, news, etc. or try the example questions below.
DISCLAIMER: The Graph Chatbot is not programmed to provide explicit or categorical answers to your questions. Rather, it transforms your questions into API requests that are distributed across the various IT services officially administered by EPFL. Its purpose is solely to collect and recommend relevant references to content that you can explore to help you answer your questions.
We provide a theoretical description of dynamical heterogeneities in glass-forming liquids, based on the premise that relaxation occurs via local rearrangements coupled by elasticity. In our framework, the growth of the dynamical correlation length e and o ...
The temperature-dependent properties of the aqueous electron have been extensively studied using mixed quantum-classical simulations in a wide range of thermodynamic conditions based on one-electron pseudopotentials. While the cavity model appears to expla ...
This thesis presents the first cavity quantum electrodynamics experiments performed with a degenerate gas of 6Li with strong atom-atom interactions. The first part of this manuscript describes the design and the building of the apparatus that has been e ...
Vapor fluxes in snow are often inferred from the temperature field by assuming vapor concentrations in local thermodynamic equilibrium with the temperature. Here we give evidence that, at the pore scale, this picture is in clear contradiction with the obse ...
Atomistic simulations provide insights into structure-property relations on an atomic size and length scale, that are complementary to the macroscopic observables that can be obtained from experiments. Quantitative predictions, however, are usually hindere ...
2021
, ,
Out-of-equilibrium systems continuously generate entropy, with its rate of production being a fingerprint of nonequilibrium conditions. In small-scale dissipative systems subject to thermal noise, fluctuations of entropy production are significant. Hithert ...
AMER PHYSICAL SOC2023
,
Emulsion drops with defined sizes are frequently used to conduct chemical reactions on picoliter scales or as templates to form microparticles. Despite tremendous progress that has been achieved in the production of emulsions, the high throughput formation ...
AMER CHEMICAL SOC2022
, , ,
CsPbBr3 has received wide attention due to its superior emission yield and better thermal stability compared to other organic-inorganic lead halide perovskites. In this study, through an interplay of theory and experiments, we investigate the molecular ori ...
2021
, , , , , ,
Machine-learning models have emerged as a very effective strategy to sidestep time-consuming electronic-structure calculations, enabling accurate simulations of greater size, time scale, and complexity. Given the interpolative nature of these models, the r ...
In this letter we present a finite temperature approach to a high-dimensional inference problem, the Wigner spiked model, with group-dependent signal-to-noise ratios. For two classes of convex and non-convex network architectures the error in the reconstru ...