| 1 |
Electronic Structure Investigation of the Bulk Properties of Uranium-Plutonium Mixed Oxides (U, Pu)O-2
Njifon IC, Bertolus M, Hayn R, Freyss M
Inorganic Chemistry, 57(17), 10974, 2018 |
| 2 |
Determination of Krypton Diffusion Coefficients in Uranium Dioxide Using Atomic Scale Calculations
Vathonne E, Andersson DA, Freyss M, Perriot R, Cooper MWD, Stanek CR, Bertolus M
Inorganic Chemistry, 56(1), 125, 2017 |
| 3 |
Toward the comparison of rare earth element and actinide behavior in materials: A computational study of Ce- and U-bearing britholites
Bertolus M, Defranceschi M
Journal of Physical Chemistry B, 110(39), 19226, 2006 |
| 4 |
Investigating bonding in small silicon-carbon clusters: Exploration of the potential energy surfaces of Si3C4, Si4C3, and Si4C4 using ab initio molecular dynamics
Bertolus M, Finocchi F, Millie P
Journal of Chemical Physics, 120(9), 4333, 2004 |
| 5 |
Investigating bonding in small silicon-carbon clusters: Exploration of the potential energy surfaces of Si3C4, Si4C3, and Si4C4 using ab initio molecular dynamics (vol 120, pg 4333, 2004)
Bertolus M, Finocchi F, Millie P
Journal of Chemical Physics, 120(22), 10853, 2004 |
| 6 |
Are lithium hydride clusters purely ionic? Study using model potentials and density-functional theory
Bertolus M, Brenner V, Millie P
Journal of Chemical Physics, 115(9), 4070, 2001 |
