The multi-state CASPT2 method
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference29 articles.
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3. Second‐order perturbation theory with a complete active space self‐consistent field reference function
4. B.O. Roos, K. Andersson, M.P. Fülscher, P.-Å. Malmqvist, L. Serrano-Andrés, K. Pierloot, M. Merchán, Multiconfigurational perturbation theory: Applications in electronic spectroscopy, in: I. Prigogine, S.A. Rice (Eds.), Advances in Chemical Physics: New Methods in Computational Quantum Mechanics, vol. XCIII, Wiley, New York, 1996, p.219.
5. Generalized Møller—Plesset perturbation theory applied to general MCSCF reference wave functions
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