124 citations · 406 across the 10 of their papers we have counts for
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Tuning the Electronic Structure of Anatase Through Fluorination
Dario Corradini, Damien Dambournet, Mathieu Salanne
A highly fluorinated anatase lattice has been recently reported, providing a new class of materials whose general chemical formula is $\rm Ti_{1- \mathit x}\square_{\mathit x}X_{4\…
Prediction of the thermophysical properties of molten salt fast reactor fuel from first-principles
A. E. Gheribi, D. Corradini, L. Dewan +4
Molten fluorides are known to show favorable thermophysical properties which make them good candidate coolants for nuclear fission reactors. Here we investigate the special case of…
Effect of dispersion interactions on the properties of LiF in condensed phases
Dario Corradini, Dario Marrocchelli, Paul A. Madden +1
Classical molecular dynamics simulations are performed on LiF in the framework of the polarizable ion model. The overlap-repulsion and polarization terms of the interaction potenti…