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• A Nonnested Augmented Subspace Method for Kohn-Sham Equation

  Guanghui Hu, Hehu Xie, Fei Xu, Gang Zhao

  2026-02-15

  3769 127 Pages:417-447

• Implementation of the Projector Augmented-Wave Method: The Use of Atomic Datasets in the Standard PAW-XML Format

  Jun Fang, Xingyu Gao, Haifeng Song

  2019-07-02

  47142 3197 Pages:1196-1223

• An Unconditionally Energy-Stable and Orthonormality-Preserving Scheme for the Kohn-Sham Gradient Flow Based Model Based on a Tetrahedral Spectral Element Method

  Hongfei Zhan, Ting Wang, Guanghui Hu

  2025-04-27

  9276 535 Pages:921-941