425 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- Centre National de la Recherche ScientifiqueFR43 papers
- EDF Energy (United Kingdom)GB24 papers
- CERMICSFR17 papers
- Université Paris-SaclayFR17 papers
- Institut de Mathématiques de ToulouseFR16 papers
- Commissariat à l'Énergie Atomique et aux Énergies AlternativesFR14 papers
- Institut national de recherche en sciences et technologies du numériqueFR14 papers
- Laboratoire de Probabilités, Statistique et ModélisationFR14 papers
- Université Toulouse III - Paul SabatierFR13 papers
- Centre de Mathématiques Appliquées de l'École polytechniqueFR12 papers
- École PolytechniqueFR12 papers
- Laboratoire de Probabilités et Modèles AléatoiresFR12 papers
11 papers · 1 filter
Enhanced Electron Extraction in Co-Doped TiO2 Quantified by Drift-Diffusion Simulation for Stable CsPbI3 Solar Cells
Thomas W. Gries, Davide Regaldo, Hans Koebler +22
Solar cells based on inorganic perovskite CsPbI3 are promising candidates to resolve the challenge of operational stability in the field of perovskite photovoltaics. For stable ope…
A collinear-spin machine learned interatomic potential for FeCrNi alloy
Lakshmi Shenoy, Christopher D. Woodgate, Julie B. Staunton +4
We have developed a new machine learned interatomic potential for the prototypical austenitic steel FeCrNi, using the Gaussian approximation potential (GAP) framework.…
Development of a Plasticity-oriented Interatomic Potential for CrFeMnNi High Entropy Alloys
Ayobami Daramola, Giovanni Bonny, Gilles Adjanor +3
An interatomic potential (termed EAM-21) has been developed with the embedded atomic method (EAM) for CrFeMnNi quaternary HEAs. This potential is based on a previously developed po…
Ultrasonic monitoring of stress and cracks of the 1/3 scale mock-up of nuclear reactor concrete containment structure
Qi Xue, Eric Larose, Ludovic Moreau +3
To evaluate the stress level and damage of a reinforced concrete containment wall and its reaction to pressure variations, we implemented successive ultrasonic experiments on the e…
The dominant mechanisms for the formation of solute-rich clusters in low-Cu steels under irradiation
N. Castin, G. Bonny, A. Bakaev +6
The formation of nano-sized, coherent, solute-rich clusters (NSRC) is known to be an important factor causing the degradation of the macroscopic properties of steels under irradiat…
Effects of the grain size and shape on the flow stress: A dislocation dynamics study
Maoyuan Jiang, Benoit Devincre, Ghiath Monnet
Dislocation dynamics simulation is used to investigate the effect of grain size and grain shape on the flow stress in model copper grains. We consider grains of 1.25-10 m size,…
Complete characterization of sink-strengths for 1D to 3D mobilities of defect clusters: Bridging between limiting cases with effective sink-strengths calculations
Gilles Adjanor
In a companion paper, we proposed new analytical expressions of cluster sink-strengths (CSS) indispensable to any complete parameterization of rate equations cluster dynamics accou…
Complete characterization of sink-strengths for mutually 1D-mobile defect clusters: Extension to diffusion anisotropy analog cases
Gilles Adjanor
Simulating more than seconds of microstructure evolution in systems involving almost athermally or very fast diffusing species such as self-interstitial atom (SIA) clusters current…
Cluster dynamics modelling of materials: a new hybrid deterministic/stochastic coupling approach
Pierre Terrier, Manuel Athènes, Thomas Jourdan +2
Deterministic simulations of the rate equations governing cluster dynamics in materials are limited by the number of equations to integrate. Stochastic simulations are limited by t…
Hybrid deterministic/stochastic algorithm for large sets of rate equations
Marco Gherardi, Thomas Jourdan, Solène Le Bourdiec +1
We propose a hybrid algorithm for the time integration of large sets of rate equations coupled by a relatively small number of degrees of freedom. A subset containing fast degrees…
A generic method for modelling the behavior of anisotropic metallic materials : application to recrystallized zirconium alloys
S. Leclercq, Gilles Rousselier, Georges Cailletaud
A simplified polycrystalline model (the so-called RL model) is proposed to simulate the anisotropic viscoplastic behavior of metallic materials. A generic method is presented that…