83 citations · 334 across the 11 of their papers we have counts for
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cond-mat.mtrl-sci2015★ 24 cited
Comparison of alpha- and beta- tin for lithium, sodium, and magnesium storage: an ab initio study including phonon contributions
Fleur Legrain, Oleksandr I. Malyi, Clas Persson +1
We present a comparative ab initio study of Li, Na, and Mg storage in tin, including phononic effects and phase competition between alpha and beta Sn. Mg doping at low concentratio…
cond-mat.mtrl-sci2015★ 71 cited
Amorphous carbon a promising material for sodium ion battery anodes: a first principles study
Fleur Legrain, Konstantinos Kotsis, Sergei Manzhos
We present a comparative ab initio computational study of sodium and lithium storage in amorphous (glassy) carbon (a-C) vs. graphite. Amorphous structures are obtained by fitting s…