Third-order Douglas–Kroll relativistic coupled-cluster theory through connected single, double, triple, and quadruple substitutions: Applications to diatomic and triatomic hydrides-Reference-Cited by-同舟云学术

Third-order Douglas–Kroll relativistic coupled-cluster theory through connected single, double, triple, and quadruple substitutions: Applications to diatomic and triatomic hydrides

Published:2004-02-15 Issue:7 Volume:120 Page:3297-3310
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Hirata So,Yanai Takeshi,de Jong Wibe A.,Nakajima Takahito,Hirao Kimihiko

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.1639361

Reference128 articles.

1. Methylene: A Paradigm for Computational Quantum Chemistry

2. Evidence for a Lower Enthalpy of Formation of Hydroxyl Radical and a Lower Gas-Phase Bond Dissociation Energy of Water

3. Evidence for a Lower Enthalpy of Formation of Hydroxyl Radical and a Lower Gas-Phase Bond Dissociation Energy of Water

4. The standard enthalpy of formation of CH2

5. Gaussian‐1 theory: A general procedure for prediction of molecular energies

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