Global Analytical Potential Hypersurface for Large Amplitude Nuclear Motion and Reactions in Methane II. Characteristic Properties of the Potential and Comparison to Other Potentials and Experimental Information-Reference-Cited by-同舟云学术

Global Analytical Potential Hypersurface for Large Amplitude Nuclear Motion and Reactions in Methane II. Characteristic Properties of the Potential and Comparison to Other Potentials and Experimental Information

Published:2004-04-01 Issue:15 Volume:108 Page:3166-3181
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Marquardt Roberto¹,Quack Martin²

Affiliation:

1. Laboratoire de Chimie Theorique, Université de Marne-la-Vallée, 5 Bd Descartes (Champs-sur-Marne), F-77454 Marne-la-Vallée CEDEX 2, France

2. Physical Chemistry, ETH Zürich, CH-8093 Zürich, Switzerland

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp037305v

Reference95 articles.

1. Global analytical potential hypersurfaces for large amplitude nuclear motion and reactions in methane. I. Formulation of the potentials and adjustment of parameters to ab initio data and experimental constraints

2. Potential energy surfaces, quasiadiabatic channels, rovibrational spectra, and intramolecular dynamics of (HF)2 and its isotopomers from quantum Monte Carlo calculations

3. Dipole moment function and equilibrium structure of methane in an analytical, anharmonic nine‐dimensional potential surface related to experimental rotational constants and transition moments by quantum Monte Carlo calculations

Cited by 84 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Comparative line position and line strength analysis of the ν2/ν4 dyad of 12CD4 and 13CD4;Journal of Quantitative Spectroscopy and Radiative Transfer;2023-12

2. The high resolution absorption spectrum of methane in the 10 800–14 000 cm⁻¹ region: literature review, new results and perspectives;Physical Chemistry Chemical Physics;2023

3. Expanded ro–vibrational analysis of the dyad region of CD4: Line positions and energy levels;Journal of Quantitative Spectroscopy and Radiative Transfer;2022-09

4. High-order contact transformations of molecular Hamiltonians: general approach, fast computational algorithm and convergence of ro-vibrational polyad models;Molecular Physics;2022-07-27

5. First Full-Dimensional Potential Energy and Dipole Moment Surfaces of SF6;The Journal of Physical Chemistry A;2020-08-03