Finding important anharmonic terms in the sixth-order potential energy function by the scaled hypersphere search method: An application to vibrational analyses of molecules and clusters-Reference-Cited by-同舟云学术

Finding important anharmonic terms in the sixth-order potential energy function by the scaled hypersphere search method: An application to vibrational analyses of molecules and clusters

Published:2008-04-14 Issue:14 Volume:128 Page:144111
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Maeda Satoshi,Watanabe Yu,Ohno Koichi

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.2884348

Reference74 articles.

1. Transferable Scaling Factors for Density Functional Derived Vibrational Force Fields

2. A systematic study of molecular vibrational anharmonicity and vibration—rotation interaction by self-consistent-field higher-derivative methods. Asymmetric top molecules

3. Vibrational spectra of furan, pyrrole, and thiophene from a density functional theory anharmonic force field

4. Anharmonic vibrational properties by a fully automated second-order perturbative approach

5. Self‐consistent field energies and wavefunctions for coupled oscillators

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