A variational calculation of the rotation—vibration energies for H2O from AB initio data
Author:
Publisher
Elsevier BV
Subject
Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry
Reference31 articles.
1. The quartic force field of H2O determined by many‐body methods. II. Effects of triple excitations
2. A study of Be2with many‐body perturbation theory and a coupled‐cluster method including triple excitations
3. A coupled cluster approach with triple excitations
4. Erratum: A coupled cluster approach with triple excitations [J. Chem. Phys. 81, 5906 (1984)]
5. A new morse oscillator-rigid bender internal dynamics (MORBID) Hamiltonian for triatomic molecules
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