Two-Dimensional H2O−Cl2 and H2O−Br2 Potential Surfaces: An Ab Initio Study of Ground and Valence Excited Electronic States-Reference-Cited by-同舟云学术

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Two-Dimensional H2O−Cl2 and H2O−Br2 Potential Surfaces: An Ab Initio Study of Ground and Valence Excited Electronic States

Published:2007-12-13 Issue:1 Volume:112 Page:89-96
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Hernández-Lamoneda Ramón¹,Uc Rosas Victor Hugo¹,Bernal Uruchurtu Margarita I.¹,Halberstadt Nadine²,Janda Kenneth C.³

Affiliation:

1. Centro de Investigaciones Químicas, UAEM, Cuernavaca, Mor. 62210, México

2. Laboratoire des Collisions, Agrégats, Réactivité, IRSAMC, CNRS, and Paul Sabatier University, 31062 Toulouse, France

3. Department of Chemistry, University of California, Irvine, Irvine, California 92697-2025

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp077074i

Reference42 articles.

1. Measurement of the sign of the dipole moment of ClF

2. HFClF: Structure and bonding

3. The Interaction of Water and Dibromine in the Gas Phase: An Investigation of the Complex H2O⋅⋅⋅Br2 by Rotational Spectroscopy and Ab Initio Calculations

4. Interaction of water and dichlorine in the gas phase: An investigation of H2O⋯Cl2 by rotational spectroscopy and ab initio calculations

5. Halogen Bonding: A New Interaction for Liquid Crystal Formation

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1. Calculated Aqueous Reduction Potentials of Neutral and Anionic Halogen Diatomic Molecules;The Journal of Physical Chemistry A;2024-07-31

2. Halogen bonding and rotational disorder in chlorine clathrate hydrate cages;The Journal of Chemical Physics;2022-03-28

3. From gas phase to condensed phases: The mutable behavior of the Br2-water interaction;Intra- and Intermolecular Interactions Between Non-covalently Bonded Species;2021

4. Density Functional Study on the Fundamental and Valence Excited States of Dibromine in T, P, and H Clathrate Cages;The Journal of Physical Chemistry A;2020-08-24

5. Halogen Bonding and Cooperative Effects in Chlorine Clathrate: Ab Initio Periodic Study;The Journal of Physical Chemistry C;2019-06-27

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