Hadrien Perron
Affiliations: | Université de Paris-Sud. Faculté des Sciences d'Orsay (Essonne) |
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Sign in to add mentor| Eric Simoni | grad student | 2007 | Université de Paris-Sud. Faculté des Sciences d'Orsay (Essonne) | |
| (Simulation par la théorie de la fonctionnelle de la densité de l’interaction de l’ion uranyle avec les surfaces de TiO2 et de NiFe2O4) | ||||
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| Sebbari K, Roques J, Simoni E, et al. (2012) First-principles molecular dynamics simulations of uranyl ion interaction at the water/rutile TiO2(110) interface Surface Science. 606: 1135-1141 |
| Beuzet E, Lamy J, Perron H, et al. (2012) Ruthenium release modelling in air and steam atmospheres under severe accident conditions using the MAAP4 code Nuclear Engineering and Design. 246: 157-162 |
| Sebbari K, Domain C, Roques J, et al. (2011) Investigation of hydrogen bonds and temperature effects on the water monolayer adsorption on rutile TiO2 (110) by first-principles molecular dynamics simulations Surface Science. 605: 1275-1280 |
| Perron H, Roques J, Domain C, et al. (2008) Theoretical investigation of the uranyl ion sorption on the rutile TiO2(110) face. Inorganic Chemistry. 47: 10991-7 |
| Levesque M, Roques J, Domain C, et al. (2008) Uranyl interaction with the hydrated (1 1 1) nickel face: A periodic density functional theory investigation Surface Science. 602: 3331-3337 |
| Perron H, Mellier T, Domain C, et al. (2007) Structural investigation and electronic properties of the nickel ferrite NiFe2O4: a periodic density functional theory approach Journal of Physics: Condensed Matter. 19: 346219 |
| Perron H, Vandenborre J, Domain C, et al. (2007) Combined investigation of water sorption on TiO2 rutile (110) single crystal face: XPS vs. periodic DFT Surface Science. 601: 518-527 |
| Perron H, Domain C, Roques J, et al. (2007) Optimisation of accurate rutile TiO 2 (110), (100), (101) and (001) surface models from periodic DFT calculations Theoretical Chemistry Accounts. 117: 565-574 |
| Perron H, Domain C, Roques J, et al. (2006) Periodic density functional theory investigation of the uranyl ion sorption on the TiO2 rutile (110) face. Inorganic Chemistry. 45: 6568-70 |
| Perron H, Domain C, Roques J, et al. (2006) Theoretical first step towards an understanding of the uranyl ion sorption on the rutile TiO2(110) face: A DFT periodic and cluster study Radiochimica Acta. 94: 601-607 |