Investigation of non-adiabatic effects for the ro-vibrational spectrum of H3+: the use of a single potential energy surface with geometry-dependent nuclear masses-Reference-Cited by-同舟云学术

Investigation of non-adiabatic effects for the ro-vibrational spectrum of H3+: the use of a single potential energy surface with geometry-dependent nuclear masses

Published:2018-04-30 Issue:23-24 Volume:116 Page:3507-3518
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Jaquet Ralph¹,Khoma Mykhaylo V.¹

Affiliation:

1. Theoretische Chemie, Universität Siegen , Siegen, Germany

Funder

Deutsche Forschungsgemeinschaft

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2018.1464225

Reference54 articles.

1. The kinetic energy operator for distance-dependent effective nuclear masses: Derivation for a triatomic molecule

2. Investigation of Nonadiabatic Effects for the Vibrational Spectrum of a Triatomic Molecule: The Use of a Single Potential Energy Surface with Distance-Dependent Masses for H3+

3. Introductory remarks

4. Spectroscopy and astronomy: H3+ from the laboratory to the Galactic center

5. Explicitly correlated potential energy surface of , including relativistic and adiabatic corrections

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3. Assigning quantum labels and improving accuracy for the ro-vibrational eigenstates of H3+ calculated using ScalIT;Frontiers in Physics;2022-10-04

4. Investigation of the global second-derivative non-adiabatic contributions: Rovibrational energies of H2+, H2, and prospects for H3+ (Part II);Journal of Molecular Spectroscopy;2022-02

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