Self‐Consistent‐Field Theory. IV. LCAO Approximation for Excited States
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1724987
Reference2 articles.
1. Self‐Consistent‐Field Theory. II. The LCAO Approximation
2. Self‐Consistent‐Field Theory. II. The LCAO Approximation
Cited by 22 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Optimization and Characterization of a Multiconfigurational Self-Consistent Field (MCSCF) State;Advances in Chemical Physics;2007-03-14
2. A review on the derivation of the spin-Restricted Hartree—Fock (RHF) Self-Consistent Field (SCF) equations for open-shell systems. Description of different methods to handle the off-diagonal Lagrangian multipliers coupling closed and open shells;Computer Physics Communications;1999-02
3. Pseudoeigenvalue methods for orbital optimization. General theory and application to closed shell, open shell, and two configuration SCF wave functions;The Journal of Chemical Physics;1983-11-15
4. Scaled one-electron hamiltonian model for open-shellLCAO-MO-SCF calculations: Comparison with the restricted open-shell method of roothaan;International Journal of Quantum Chemistry;1982-05
5. A hybrid technique of orthonormality constrained orbital optimization inSCF calculations;International Journal of Quantum Chemistry;1981-12
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