most citedAuxiliary density functionals: a new class of methods for efficient, stable density functional theory calculations

1 citations · 1 across the 1 of their papers we have counts for

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2 papers

cond-mat.str-el2018

Many-body renormalisation of forces in f-electron materials

Evgeny Plekhanov, Phil Hasnip, Vincent Sacksteder +4

We present the implementation of Dynamical Mean-Field Theory (DMFT) in the CASTEP \emph{ab-initio} code. We explain in detail the theoretical framework for DFT+DMFT and we demonstr…

cond-mat.mtrl-sci2015★ 1 cited

Auxiliary density functionals: a new class of methods for efficient, stable density functional theory calculations

P. J. Hasnip, M. I. J. Probert

A new class of methods is introduced for solving the Kohn-Sham equations of density functional theory, based on constructing a mapping dynamically between the Kohn-Sham system and…