Dynamics of the N(4S)+NO(X 2Π)→N2(X 1Σ+g)+O(3P) atmospheric reaction on the3A″ ground potential energy surface. III. Quantum dynamical study and comparison with quasiclassical and experimental results

Energy Surface ◽

Experimental Results ◽

Dynamical Study ◽

Quantum Dynamical ◽

Atmospheric Reaction ◽

A quasiclassical trajectory study of the effect of the initial rovibrational level and relative translational energy of reactants on the dynamics of the N(4Su) + O2(X 3∑−g) → NO(X 2Π) + O(3Pg) atmospheric reaction on the 2A′ ground potential energy surface

Chemical Physics ◽

10.1016/0301-0104(93)85068-j ◽

1993 ◽

Vol 178 (1-3) ◽

pp. 287-303 ◽

Cited By ~ 20

Author(s):

Miquel Gilibert ◽

Antonio Aguilar ◽

Miguel González ◽

R. Sayós

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Translational Energy ◽

Atmospheric Reaction ◽

Dynamics of the N(4Su)+NO(X 2Π)→N2(X 1Σ+g)+O(3Pg) atmospheric reaction on the3A‘ ground potential energy surface. II. The effect of reagent translational, vibrational, and rotational energies

The Journal of Chemical Physics ◽

10.1063/1.465289 ◽

1993 ◽

Vol 99 (3) ◽

pp. 1719-1733 ◽

Cited By ~ 22

Author(s):

Miquel Gilibert ◽

Antonio Aguilar ◽

Miguel González ◽

R. Sayós

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Atmospheric Reaction ◽

A quasiclassical trajectory study for the atmospheric reaction based on a new ground potential energy surface

Chemical Physics ◽

10.1016/j.chemphys.2005.01.033 ◽

2005 ◽

Vol 315 (1-2) ◽

pp. 87-96 ◽

Cited By ~ 2

Author(s):

Jianfeng He ◽

Shixing Liu ◽

Xueshen Liu ◽

Peizhu Ding

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Atmospheric Reaction ◽

Quasiclassical trajectory study of the N(4Su) + O2 (X 3Σ−g)→NO (X 2Π) + O (3Pg) atmospheric reaction on the 2A′ ground potential energy surface employing an analytical Sorbie—Murrell potential

Chemical Physics ◽

10.1016/0301-0104(93)80109-m ◽

1993 ◽

Vol 172 (1) ◽

pp. 99-115 ◽

Cited By ~ 44

Author(s):

Miquel Gilibert ◽

Antonio Aguilar ◽

Miguel González ◽

R. Sayós

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Atmospheric Reaction ◽

Dynamics of the N(4Su) + NO(X 2Π) → N2(X 1Σg+) + O(3Pg) atmospheric reaction on the 3A‘ ground potential energy surface. I. Analytical potential energy surface and preliminary quasiclassical trajectory calculations

The Journal of Chemical Physics ◽

10.1063/1.463787 ◽

1992 ◽

Vol 97 (8) ◽

pp. 5542-5553 ◽

Cited By ~ 45

Author(s):

Miquel Gilibert ◽

Antonio Aguilar ◽

Miguel González ◽

Fernando Mota ◽

R. Sayós

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Trajectory Calculations ◽

Analytical Potential ◽

Atmospheric Reaction ◽

Quantum Dynamical Study of the He + NeH+ Reaction on a New Analytical Potential Energy Surface

The Journal of Physical Chemistry A ◽

10.1021/jp408550c ◽

2013 ◽

Vol 117 (49) ◽

pp. 13070-13078 ◽

Cited By ~ 11

Author(s):

Debasish Koner ◽

Aditya N. Panda

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Dynamical Study ◽

Quantum Dynamical ◽

Analytical Potential

Dynamic study of the D + DAu reaction based on a new ground potential energy surface

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2021.113540 ◽

2021 ◽

pp. 113540

Author(s):

Ai Jie Zhang ◽

Shun Xia Yu

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Dynamic Study ◽

Ab initio QCISD(T) calculations of the ground potential energy surface of He3+

The Journal of Physical Chemistry ◽

10.1021/j100036a013 ◽

1995 ◽

Vol 99 (36) ◽

pp. 13397-13401 ◽

Cited By ~ 12

Author(s):

M. F. Satterwhite ◽

Gregory I. Gellene

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Energy Surface ◽

A Simple Picture for the Rotational Enhancement of the Rate for the F + HCl → HF + Cl Reaction: A Dynamical Study Using a New ab initio Potential Energy Surface†

The Journal of Physical Chemistry A ◽

10.1021/jp0535745 ◽

2006 ◽

Vol 110 (2) ◽

pp. 436-444 ◽

Cited By ~ 37

Author(s):

Michael Y. Hayes ◽

Michael P. Deskevich ◽

David J. Nesbitt ◽

Kaito Takahashi ◽

Rex T. Skodje

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Energy Surface ◽

Dynamical Study ◽

Simple Picture

Collisional excitation of CH(X2Π) by He: new ab initio potential energy surfaces and scattering calculations

Physical Chemistry Chemical Physics ◽

10.1039/c5cp03696h ◽

2015 ◽

Vol 17 (33) ◽

pp. 21583-21593 ◽

Cited By ~ 10

Author(s):

Sarantos Marinakis ◽

Indigo Lily Dean ◽

Jacek Kłos ◽

François Lique

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Energy Surface ◽

Experimental Results ◽

Collisional Excitation ◽

Energy Surfaces

We present a new CH(X)–He potential energy surface which is able to reproduce all the available experimental results.