15 citations · 69 across the 23 of their papers we have counts for
Showing 2013Show all
2 papers · 1 filter
physics.comp-ph2013
Gradient type optimization methods for electronic structure calculations
Xin Zhang, Jinwei Zhu, Zaiwen Wen +1
The density functional theory (DFT) in electronic structure calculations can be formulated as either a nonlinear eigenvalue or direct minimization problem. The most widely used app…
math.NA2013★ 5 cited
Adaptive Finite Element Approximations for Kohn-Sham Models
Huajie Chen, Xiaoying Dai, Xingao Gong +2
The Kohn-Sham equation is a powerful, widely used approach for computation of ground state electronic energies and densities in chemistry, materials science, biology, and nanoscien…