Long-range features of the F-HBr and F-HI potential energy surfaces from crossed molecular-beam experiments: a model analysis

Chemical Physics Letters ◽

10.1016/0009-2614(91)90080-s ◽

1991 ◽

Vol 177 (6) ◽

pp. 536-542 ◽

Author(s):

Lev Yu. Rusin ◽

Mikhail B. Sevryuk ◽

J.Peter Toennies

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Model Analysis ◽

Energy Surfaces ◽

Crossed Molecular Beam

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Long-range features of potential energy surfaces for the interaction of fluorine atoms with hydrogen chloride, hydrogen bromide, and hydrogen iodide from crossed molecular beam experiments

The Journal of Physical Chemistry ◽

10.1021/j100174a044 ◽

1991 ◽

Vol 95 (21) ◽

pp. 8248-8255 ◽

Author(s):

Vincenzo Aquilanti ◽

David Cappelletti ◽

Fernando Pirani ◽

L. Yu. Rusin ◽

M. B. Sevryuk ◽

...

Keyword(s):

Potential Energy ◽

Hydrogen Chloride ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Hydrogen Bromide ◽

Hydrogen Iodide ◽

Energy Surfaces ◽

Crossed Molecular Beam

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Dynamics of the O(1D) D2 reaction: A comparison between crossed molecular beam experiments and quasiclassical trajectory calculations on the lowest three potential energy surfaces

Molecular Physics ◽

10.1080/149920500058077 ◽

2005 ◽

Vol 103 (13) ◽

pp. 1703-1714 ◽

Author(s):

N. Balucani ◽

P. Casavecchia ◽

F. J. Aoiz ◽

L. Banares ◽

J. F. Castillo ◽

...

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Trajectory Calculations ◽

Energy Surfaces ◽

Crossed Molecular Beam

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Dynamics of the C(1D)+H2reaction: A comparison of crossed molecular beam experiments with quantum mechanical and quasiclassical trajectory calculations on the first two singlet (11A′ and 11A″) potential energy surfaces

Molecular Physics ◽

10.1080/00268970903476696 ◽

2010 ◽

Vol 108 (3-4) ◽

pp. 373-380 ◽

Author(s):

Nadia Balucani ◽

Piergiorgio Casavecchia ◽

F.J Aoiz ◽

Luis Bañares ◽

Jean-Michel Launay ◽

...

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Quantum Mechanical ◽

Trajectory Calculations ◽

Energy Surfaces ◽

Crossed Molecular Beam

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The dynamics of the prototype abstraction reaction Cl(2P3/2,1/2)+ H2: A comparison of crossed molecular beam experiments with exact quantum scattering calculations on coupled ab initio potential energy surfaces

Physical Chemistry Chemical Physics ◽

10.1039/b410119g ◽

2004 ◽

Vol 6 (21) ◽

pp. 5007 ◽

Author(s):

Nadia Balucani ◽

Dimitris Skouteris ◽

Giovanni Capozza ◽

Enrico Segoloni ◽

Piergiorgio Casavecchia ◽

...

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Quantum Scattering ◽

Exact Quantum ◽

Abstraction Reaction ◽

Energy Surfaces ◽

Crossed Molecular Beam

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Quantum mechanical and quasiclassical simulations of molecular beam experiments for the F+H2→HF+H reaction on two ab initio potential energy surfaces

The Journal of Chemical Physics ◽

10.1063/1.477401 ◽

1998 ◽

Vol 109 (17) ◽

pp. 7224-7237 ◽

Author(s):

J. F. Castillo ◽

B. Hartke ◽

H.-J. Werner ◽

F. J. Aoiz ◽

L. Bañares ◽

...

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Potential Energy Surfaces ◽

Molecular Beam ◽

Quantum Mechanical ◽

Energy Surfaces

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Erratum: “Analytic Morse/long-range potential energy surfaces and ‘adiabatic-hindered-rotor’ treatment for a symmetric top-linear molecule dimer: A case study of CH3F–H2” [J. Chem. Phys. 148, 124302 (2018)]

The Journal of Chemical Physics ◽

10.1063/1.5105344 ◽

2019 ◽

Vol 150 (20) ◽

pp. 209901 ◽

Author(s):

Xiao-Long Zhang ◽

Yong-Tao Ma ◽

Yu Zhai ◽

Hui Li

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Chem Phys ◽

Linear Molecule ◽

Range Potential ◽

Energy Surfaces

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Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO2–H2

The Journal of Chemical Physics ◽

10.1063/1.3428619 ◽

2010 ◽

Vol 132 (21) ◽

pp. 214309 ◽

Author(s):

Hui Li ◽

Pierre-Nicholas Roy ◽

Robert J. Le Roy

Keyword(s):

Potential Energy ◽

Infrared Spectra ◽

Potential Energy Surfaces ◽

Range Potential ◽

Energy Surfaces

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Theoretical studies of fine‐structure effects and long‐range forces: Potential‐energy surfaces and reactivity of O(3P)+OH(2Π)

The Journal of Chemical Physics ◽

10.1063/1.457986 ◽

1990 ◽

Vol 92 (4) ◽

pp. 2423-2439 ◽

Author(s):

M. M. Graff ◽

A. F. Wagner

Keyword(s):

Fine Structure ◽

Potential Energy ◽

Potential Energy Surfaces ◽

Theoretical Studies ◽

Energy Surfaces

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Role of the middle and long range parts of the NO2 potential energy surfaces: anomalous density of states and recombination rate constant

Physical Chemistry Chemical Physics ◽

10.1039/b211547f ◽

2003 ◽

Vol 5 (10) ◽

pp. 2039 ◽

Author(s):

S. Heilliette ◽

A. Delon ◽

D. Reignier ◽

T. Stoecklin ◽

J. C. Rayez

Keyword(s):

Potential Energy ◽

Density Of States ◽

Rate Constant ◽

Recombination Rate ◽

Potential Energy Surfaces ◽

Anomalous Density ◽

Recombination Rate Constant ◽

Energy Surfaces

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Potential Energy Surfaces for F−H2and Cl−H2: Long-Range Interactions and Nonadiabatic Couplings†

The Journal of Physical Chemistry A ◽

10.1021/jp003782r ◽

2001 ◽

Vol 105 (11) ◽

pp. 2401-2409 ◽

Author(s):

Vincenzo Aquilanti ◽

Simonetta Cavalli ◽

Fernando Pirani ◽

Alessandro Volpi ◽

David Cappelletti

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Long Range Interactions ◽

Energy Surfaces

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