Interactions of Hydrogen Molecules with Halogen-Containing Diatomics from Ab Initio Calculations: Spherical-Harmonics Representation and Characterization of the Intermolecular Potentials-Reference-Cited by-同舟云学术

Interactions of Hydrogen Molecules with Halogen-Containing Diatomics from Ab Initio Calculations: Spherical-Harmonics Representation and Characterization of the Intermolecular Potentials

Published:2016-04-22 Issue:27 Volume:120 Page:5315-5324
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Albernaz Alessandra F.¹,Aquilanti Vincenzo²,Barreto Patricia R. P.³,Caglioti Concetta²,Cruz Ana Claudia P. S.³,Grossi Gaia²,Lombardi Andrea²,Palazzetti Federico²⁴

Affiliation:

1. Instituto de Física, Universidade de Brasília, CP04455, Brasília, Distrito Federal CEP 70919-970, Brazil

2. Dipartimento di Chimica, Biologia e Biotecnologie, Università di Perugia, via Elce di Sotto 8, 06123 Perugia, Italy

3. Instituto Nacional de Pesquisas Espaciais (INPE)/MCT, Laboratòrio Associado de Plasma (LAP), CP515, São José dos Campos, São Paulo CEP 12247-970, Brazil

4. Scuola Normale Superiore, Piazza dei Cavalieri 7, 56126, Pisa, Italy

Funder

Ministero dell’Istruzione, dell’Università e della Ricerca

Dipartimento di Chimica, Biologia e Biotecnologie, Università Degli Studi di Perugia

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.6b01718

Reference42 articles.

1. Atom–bond pairwise additive representation for intermolecular potential energy surfaces