Structured eigenvalue problems in electronic structure methods from a unified perspective
Author:
Affiliation:
1. Key Laboratory of Theoretical and Computational Photochemistry, Ministry of Education, College of Chemistry, Beijing Normal University, Beijing 100875, China
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry
Link
https://cps.scitation.org/doi/pdf/10.1063/1674-0068/cjcp2107119
Reference31 articles.
1. Introduction to Relativistic Quantum Chemistry
2. Equations-of-Motion Method and the Extended Shell Model
3. Time-reversal symmetry, Kramers' degeneracy and the algebraic eigenvalue problem
4. A quaternion QR algorithm
5. Quaternion symmetry in relativistic molecular calculations: The Dirac–Hartree–Fock method
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1. Time-reversal symmetry adaptation in relativistic density matrix renormalization group algorithm;The Journal of Chemical Physics;2023-01-26
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