34 citations · 34 across the 1 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2020★ 34 cited
The CECAM Electronic Structure Library and the modular software development paradigm
Micael J. T. Oliveira, Nick Papior, Yann Pouillon +34
First-principles electronic structure calculations are very widely used thanks to the many successful software packages available. Their traditional coding paradigm is monolithic,…
cond-mat.dis-nn2020
Evolution of amorphous structure under irradiation: zircon case study
A. Diver, O. Dicks, A. M. Elena +2
The nature of the amorphous state has been notably difficult to ascertain at the microscopic level. In addition to the fundamental importance of understanding the amorphous state,…
cond-mat.other2005
Automatic Generation of Matrix Element Derivatives for Tight Binding Models
Alin M. Elena, Matthias Meister
Tight binding (TB) models are one approach to the quantum mechanical many particle problem. An important role in TB models is played by hopping and overlap matrix elements between…