Fast vibrational self-consistent field calculations through a reduced mode–mode coupling scheme
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1631817
Reference27 articles.
1. Variational Approaches to Vibration-Rotation Spectroscopy for Polyatomic Molecules
2. Self‐consistent field energies and wavefunctions for coupled oscillators
3. Ab initio calculation of anharmonic vibrational states of polyatomic systems: Electronic structure combined with vibrational self-consistent field
4. General atomic and molecular electronic structure system
5. Anharmonic Vibrational Spectroscopy of Glycine: Testing of ab Initio and Empirical Potentials
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