369 citations · 659 across the 14 of their papers we have counts for
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cond-mat.mtrl-sci2011★ 2 cited
The Tight-Binding method: application to AB s-valent dimer
D. G. Pettifor
The AB s-valent dimer is used to analyse bond formation and charge transfer within the tight-binding (TB) approximation. In this way a physical interpretation of the electronic str…
cond-mat.mtrl-sci2011★ 51 cited
Van der Waals interactions in the ground state of Mg(BH4)2 from density functional theory
A. Bil, B. Kolb, R. Atkinson +3
In order to resolve an outstanding discrepancy between experiment and theory regarding the ground-state structure of Mg(BH4)2, we examine the importance of long-range dispersive in…