Studies of the local structures of molten metal halides

AL Rollet, M Salanne - Annual Reports Section" C"(Physical Chemistry …, 2011 - pubs.rsc.org
This review covers the local structure of molten metal halide, where a somewhat wide
definition of “local structure” is employed, ie from the first shell of interacting neighbours up …

Including many-body effects in models for ionic liquids

M Salanne, B Rotenberg, S Jahn, R Vuilleumier… - Theoretical Chemistry …, 2012 - Springer
Realistic modeling of ionic systems necessitates taking explicitly account of many-body
effects. In molecular dynamics simulations, it is possible to introduce explicitly these effects …

Novel synthesis of high performance anode materials for lithium-ion batteries (LIBs)

WW Lee, JM Lee - Journal of Materials Chemistry A, 2014 - pubs.rsc.org
Novel synthesis of high performance anode materials for lithium-ion batteries (LIBs) - Journal of
Materials Chemistry A (RSC Publishing) DOI:10.1039/C3TA12830J Royal Society of Chemistry …

The electrochemistry of intermetallic compounds: A mini-review

N Ivanova - Electrochemistry Communications, 2017 - Elsevier
Intermetallic compounds are very promising materials for a range of applications. In this mini-
review, the cathodic deposition and anodic oxidation of intermetallic compounds are …

A comparison of square-wave voltammetry models to determine the number of electrons exchanged in metal deposition

R Fuller, T Williams, M Schvaneveldt, D Rappleye - Electrochimica Acta, 2022 - Elsevier
A comparison of square-wave voltammetry models for calculating the number of electrons
exchanged in a metal deposition reaction. Experiments were conducted for silver deposition …

Efficient recovery of the fission element neodymium by electrodeposition from molten LiCl–KCl and research on the thermodynamics and dynamics of processes

Y Wang, Q Liu, M Quan, Y Liu, Y Chen… - ACS Sustainable …, 2022 - ACS Publications
The efficient extraction of neodymium, a neutron poison, is of great significance in the dry
reprocessing process for the nuclear fuel cycle. The electrochemical extraction of …

Potential-induced ordering transition of the adsorbed layer at the ionic liquid/electrified metal interface

S Tazi, M Salanne, C Simon, P Turq… - The Journal of …, 2010 - ACS Publications
The potential-driven ordering transition of a LiCl layer adsorbed on the (100) surface of a
metallic aluminum electrode is studied by molecular dynamics simulations. The transition …

Electrochemical extraction of gadolinium on Sn electrode and preparation of Sn-Gd intermetallic compounds in LiCl-KCl melts

Y Wang, M Quan, S Zhang, Y Liu, Y Wang, Y Dai… - Journal of Alloys and …, 2022 - Elsevier
For the development of nuclear energy, it is important to remove the fission products which
hinder nuclear reactions. In this paper, Gd was extracted by an electrochemical method in …

Study of NaF–AlF3 Melts by Coupling Molecular Dynamics, Density Functional Theory, and NMR Measurements

K Machado, D Zanghi, V Sarou-Kanian… - The Journal of …, 2017 - ACS Publications
Improvement of the industrial electrolytic process for aluminum production necessitates a
thorough understanding of the underlying ionic structure of the electrolyte, which mainly …

Europium induced alloy corrosion and cracking in molten chloride media for nuclear applications

S Guo, W Zhuo, Y Wang, J Zhang - Corrosion Science, 2020 - Elsevier
Molten chloride salts can be corrosive to the structural alloys used in nuclear applications
where they have been considered as advanced coolants and electrolytes. This paper …