Ab initio characterization of the Ne–I2 van der Waals complex: Intermolecular potentials and vibrational bound states

Laura Delgado-Tellez; Álvaro Valdés; Rita Prosmiti; Pablo Villarreal; Gerardo Delgado-Barrio

doi:10.1063/1.3596604

Ab initio characterization of the Ne–I2 van der Waals complex: Intermolecular potentials and vibrational bound states

The Journal of Chemical Physics ◽

10.1063/1.3596604 ◽

2011 ◽

Vol 134 (21) ◽

pp. 214304 ◽

Cited By ~ 20

Author(s):

Laura Delgado-Tellez ◽

Álvaro Valdés ◽

Rita Prosmiti ◽

Pablo Villarreal ◽

Gerardo Delgado-Barrio

Keyword(s):

Ab Initio ◽

Bound States ◽

Van Der Waals ◽

Intermolecular Potentials ◽

Van Der Waals Complex

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Ab Initio studies of the interaction potential for the Xe–NO(X 2Π) van der Waals complex: Bound states and fully quantum and quasi-classical scattering

The Journal of Chemical Physics ◽

10.1063/1.4731286 ◽

2012 ◽

Vol 137 (1) ◽

pp. 014312 ◽

Cited By ~ 17

Author(s):

J. Kłos ◽

F. J. Aoiz ◽

M. Menéndez ◽

M. Brouard ◽

H. Chadwick ◽

...

Keyword(s):

Ab Initio ◽

Interaction Potential ◽

Bound States ◽

Van Der Waals ◽

Van Der Waals Complex

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Bound States of the Cl(2P)−HCl van der Waals Complex from Coupled ab Initio Potential Energy Surfaces

The Journal of Physical Chemistry A ◽

10.1021/jp046260a ◽

2004 ◽

Vol 108 (42) ◽

pp. 9319-9322 ◽

Cited By ~ 5

Author(s):

W. B. Zeimen ◽

J. Kłos ◽

G. C. Groenenboom ◽

A. van der Avoird

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Bound States ◽

Van Der Waals ◽

Van Der Waals Complex ◽

Energy Surfaces

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Ab initio intermolecular potential energy surface, bound states, and microwave spectra for the van der Waals complex Ne–HCCCN

The Journal of Chemical Physics ◽

10.1063/1.1888567 ◽

2005 ◽

Vol 122 (17) ◽

pp. 174312 ◽

Cited By ~ 2

Author(s):

Yanzi Zhou ◽

Daiqian Xie

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Bound States ◽

Energy Surface ◽

Van Der Waals ◽

Intermolecular Potential ◽

Van Der Waals Complex ◽

Microwave Spectra

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Ab initio characterization of the Mg–HF van der Waals complex

The Journal of Chemical Physics ◽

10.1063/1.3497187 ◽

2010 ◽

Vol 133 (16) ◽

pp. 164305 ◽

Cited By ~ 2

Author(s):

Jacek Koput ◽

Jan Makarewicz

Keyword(s):

Ab Initio ◽

Van Der Waals ◽

Van Der Waals Complex

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Ab initio characterization of the Ca–HCl van der Waals complex

The Journal of Chemical Physics ◽

10.1063/1.3318467 ◽

2010 ◽

Vol 132 (6) ◽

pp. 064307 ◽

Cited By ~ 8

Author(s):

Jacek Koput ◽

Jan Makarewicz

Keyword(s):

Ab Initio ◽

Van Der Waals ◽

Van Der Waals Complex

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Bound States of the Cl(2P)−HCl van der Waals Complex from Coupled ab Initio Potential Energy Surfaces

The Journal of Physical Chemistry A ◽

10.1021/jp034475z ◽

2003 ◽

Vol 107 (25) ◽

pp. 5110-5121 ◽

Cited By ~ 12

Author(s):

W. B. Zeimen ◽

J. Kłos ◽

G. C. Groenenboom ◽

A. van der Avoird

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Bound States ◽

Van Der Waals ◽

Van Der Waals Complex ◽

Energy Surfaces

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SEQUENTIAL CAPTURE OF O(3P) AND HCN BY HELIUM NANODROPLETS: INFRARED SPECTROSCOPY OF THE VAN DER WAALS COMPLEX SUPPLEMENTED BY AB INITIO COMPUTATIONS OF THE POTENTIAL ENERGY SURFACE AND BOUND STATES

Proceedings of the 2020 International Symposium on Molecular Spectroscopy ◽

10.15278/isms.2020.wd08 ◽

2020 ◽

Author(s):

Peter Franke ◽

Gary Douberly

Keyword(s):

Infrared Spectroscopy ◽

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Bound States ◽

Energy Surface ◽

Van Der Waals ◽

Helium Nanodroplets ◽

Van Der Waals Complex ◽

Ab Initio Computations

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Is the Ar-Br2(X1Sigma+g van der Waals complex linear rather than T-shaped? A study in terms of ab initio based potential energy surfaces

Molecular Physics ◽

10.1080/002689799164874 ◽

1999 ◽

Vol 96 (7) ◽

pp. 1043-1049 ◽

Cited By ~ 1

Author(s):

F. Y. NAUMKIN

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Van Der Waals ◽

Van Der Waals Complex ◽

Complex Linear ◽

Energy Surfaces

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Infrared spectra, relative stability, and ab initio calculations of the methyl-d3 chloride-hydrogen chloride van der Waals complex observed in liquefied argon

The Journal of Physical Chemistry ◽

10.1021/j100143a017 ◽

1993 ◽

Vol 97 (41) ◽

pp. 10622-10629 ◽

Cited By ~ 8

Author(s):

W. A. Herrebout ◽

B. J. van der Veken

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Hydrogen Chloride ◽

Infrared Spectra ◽

Relative Stability ◽

Van Der Waals ◽

Van Der Waals Complex

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An ab initio investigation of the potential energy surface of the benzene—neon van der Waals complex

Chemical Physics Letters ◽

10.1016/0009-2614(92)85548-o ◽

1992 ◽

Vol 195 (5-6) ◽

pp. 482-486 ◽

Cited By ~ 19

Author(s):

Th. Brupbacher ◽

H.P. Lüthi ◽

A. Bauder

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Energy Surface ◽

Van Der Waals ◽

Van Der Waals Complex

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