An efficient first-order CASSCF method based on the renormalized Fock-operator technique

Author:

Meier U.,Staemmler V.

Publisher

Springer Science and Business Media LLC

Subject

Chiropractics,Physical and Theoretical Chemistry

Reference40 articles.

1. Olsen J, Yeager DL, J�rgensen P (1983) Optimization and characterization of a multiconfigurational self-consistent field (MCSCF) state. Adv Chem Phys 54:1

2. Werner HJ (1987) Matrix-formulated direct multiconfiguration self-consistent field and multiconfiguration-interaction methods. Adv Chem Phys 69:1

3. Shepard R (1987) The multiconfiguration self-consistent field method. Adv Chem Phys 69:63

4. Roos BO (1987) The complete active space self-consistent field method and its applications in electronic structure calculations. Adv Chem Phys 69:399

5. Alml�f J, Roos B, Siegbahn P (1978) Comput Chem 2:89

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