Author

Nicolas Salles

Observed names: N Salles, N. Salles, Nicolas SALLES, Nicolas, Salles, Salles, Nicolas

Observed institutions: Université Paris-Sud, Centre National de la Recherche Scientifique, Scuola Internazionale Superiore di Studi Avanzati, Université de Bourgogne, Université Fédérale de Toulouse Midi-Pyrénées, Laboratoire d'Analyse et d'Architecture des Systèmes, University of Nova Gorica, Commissariat à l'Énergie Atomique et aux Énergies Alternatives, AREA Science Park, Istituto Officina dei Materiali, STMicroelectronics (France), Ruđer Bošković Institute, Laboratoire Interdisciplinaire Carnot de Bourgogne, Institut de Chimie Moléculaire et des Matériaux d'Orsay, Université de Toulouse, Université de Montréal

ORCID: 0000-0003-3600-5754

Observed ORCID: 0000-0003-3600-5754

OpenAlex ID: A5076690520

Finding Reaction Pathways and Transition States: r-ARTn and d-ARTn as an Efficient and Versatile Alternative to String Approaches

2020 · Antoine Jay, Christophe Huet, et al. · Journal of Chemical Theory and Computation · 36

Activation–Relaxation Technique: An efficient way to find minima and saddle points of potential energy surfaces

2022 · Antoine Jay, Miha Gunde, et al. · Computational Materials Science · 21

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Atomistic simulation and interatomic potential comparison in α -Al 2 O 3 : lattice, surface and extended-defects properties

2022 · Qinqin Xu, Nicolas Salles, et al. · Modelling and Simulation in Materials Science and Engineering · 18

Molecular dynamics study of high-pressure alumina polymorphs with a tight-binding variable-charge model

2015 · N. Salles, O. Politano, et al. · Computational Materials Science · 18

IRA: A Shape Matching Approach for Recognition and Comparison of Generic Atomic Patterns

2021 · Miha Gunde, Nicolas Salles, et al. · Journal of Chemical Information and Modeling · 14

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SrTiO3 (001) surface and strained thin films: Atomic simulations using a tight-binding variable-charge model

2013 · R. Tétot, N. Salles, et al. · Surface Science · 14

Strain-driven diffusion process during silicon oxidation investigated by coupling density functional theory and activation relaxation technique

2017 · N. Salles, N. Richard, et al. · The Journal of Chemical Physics · 12

Collective dipole effects in ionic transport under electric fields

2020 · N. Salles, L. Martin-Samos, et al. · Nature Communications · 11

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Improved Tight-Binding Charge Transfer Model and Calculations of Energetics of a Step on the Rutile TiO2(110) Surface

2015 · Emile Maras, Nicolas Salles, et al. · The Journal of Physical Chemistry C · 11

pARTn: A plugin implementation of the Activation Relaxation Technique nouveau that takes over the FIRE minimisation algorithm

2023 · M. Poberznik, M. Gunde, et al. · Computer Physics Communications · 8

Improved SMTB-Q model applied to oxygen migration and pressure phase transitions in UO 2

2019 · D Mbongo, R Tétot, et al. · Journal of Physics Condensed Matter · 7

Exploring potential energy surfaces to reach saddle points above convex regions

2024 · M. Gunde, A. Jay, et al. · The Journal of Chemical Physics · 5

SOFI: Finding point group symmetries in atomic clusters as finding the set of degenerate solutions in a shape-matching problem

2024 · M. Gunde, N. Salles, et al. · The Journal of Chemical Physics · 3

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Iterative Rotations and Assignments (IRA): A shape matching algorithm for atomic structures

2022 · Miha Gunde, Nicolas Salles, et al. · Software Impacts · 2

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Modeling of the interface formation during CuO deposition on Al(111) substrate: linking material design and elaboration process parameters through multi-levels approach

2017 · M Guiltat, N Salles, et al. · Modelling and Simulation in Materials Science and Engineering · 2

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Kinetic Monte Carlo for Process Simulation: First Principles Calibrated Parameters for BO2

2021 · Pierre-Louis Julliard, Antoine Jay, et al. · International Conference on Simulation of Semiconductor Processes and Devices · 1

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An off-lattice kinetic Monte Carlo kernel guided by topological and geometrical analysis to bridge accurate ab-initio calculations and large scale simulations

2021 · Gunde, Miha, Salles, Nicolas, et al. · HAL · 1

Defect creation and Diffusion under electric fields from first-principles: the prototypical case of silicon dioxide

2019 · N. Salles, L. Martin-Samos, et al. · International Conference on Simulation of Semiconductor Processes and Devices · 1

Equidistribution of points on the hypersphere including symmetries

2026 · Antoine Jay, Matic Poberžnik, et al. · SSRN Electronic Journal

Diffusion studies in UO2 with an improved tight-binding potential: SMTB-QB

2025 · Théo Roubille, Roland Ducher, et al. · Acta Materialia

Reference Depolarization Values for Polar-Organic Aggregates

2025 · Gabriela Herrero-Saboya, Matic Poberznik, et al. · Journal of Chemical Theory and Computation

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Caractériser les cinétiques des diffusions atomiques

2025 · Jay, Antoine, Mousseau, Normand, et al. · Cairn.info

Caractériser les cinétiques des diffusions atomiques - ART : l’explorateur de surfaces d’énergie potentielle

2023 · Antoine JAY, Normand MOUSSEAU, et al. · Opérations unitaires. Génie de la réaction chimique

Partn: A Plugin Implementation of the Activation Relaxation Technique Nouveau Hijacking a Minimisation Algorithm

2023 · Matic Poberžnik, Miha Gunde, et al. · SSRN Electronic Journal

Benchmark dataset for the Iterative Rotations and Assignments (IRA) algorithm

2021 · Gunde, Miha, Salles, Nicolas, et al. · Zenodo (CERN European Organization for Nuclear Research)

Works count: 40

Citation count: 185

H-index: 9

I10-index: 9