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The time-delay route to reactive scattering resonances:: the case of the F+H2→HF+H reaction
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作者:

Cavalli, Simonetta
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Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

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[1] Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[2] CNR, Ist Metodol Inorgan & Plasmi, I-70126 Bari, Italy
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D O I:
10.1088/0031-8949/76/3/N03
中图分类号:
O4 [物理学];
学科分类号:
0702 ;
摘要:
In this paper, the interesting case of two overlapping resonances which occur in the F + H-2 reaction is revisited emphasizing the role of the total angular momentum. We show that molecular rotations of the triatomic collision complex are responsible for the alignment of a short-lived compound state, localized in the transition state region of the potential energy surface, with an exit-channel van der Waals metastable state. The changes induced by the total angular momentum on both positions and lifetimes make the resonances to interfere and produce quantum oscillating structures in integral and differential cross-sections.
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页码:C21 / C27
页数:7
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共 38 条
[1]
Quantum scattering calculations on chemical reactions
[J].
Althorpe, SC
;
Clary, DC
.
ANNUAL REVIEW OF PHYSICAL CHEMISTRY,
2003, 54
:493-529

Althorpe, SC
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Exeter, Sch Chem, Exeter EX4 4QD, Devon, England Univ Exeter, Sch Chem, Exeter EX4 4QD, Devon, England

Clary, DC
论文数: 0 引用数: 0
h-index: 0
机构: Univ Exeter, Sch Chem, Exeter EX4 4QD, Devon, England
[2]
Probabilities for the F+H2→HF+H reaction by the hyperquantization algorithm:: alternative sequential diagonalization schemes
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Volpi, A
;
Aguilar, A
;
Giménez, X
;
Lucas, JM
.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS,
1999, 1 (06)
:1091-1098

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

论文数: 引用数:
h-index:
机构:

Volpi, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Giménez, X
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[3]
Direct evaluation of the lifetime matrix by the hyperquantization algorithm:: Narrow resonances in the F+H2 reaction dynamics and their splitting for nonzero angular momentum -: art. no. 054314
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Simoni, A
;
Tscherbul, TV
.
JOURNAL OF CHEMICAL PHYSICS,
2005, 123 (05)

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

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h-index:
机构:

Simoni, A
论文数: 0 引用数: 0
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机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Tscherbul, TV
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[4]
Benchmark rate constants by the hyperquantization algorithm.: The F+H2 reaction for various potential energy surfaces:: features of the entrance channel and of the transition state, and low temperature reactivity
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Volpi, A
;
Aguilar, A
;
Lucas, JM
.
CHEMICAL PHYSICS,
2005, 308 (03)
:237-253

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

De Fazio, D
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Volpi, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[5]
Lifetime of reactive scattering resonances:: Q-matrix analysis and angular momentum dependence for the F+H2 reaction by the hyperquantization algorithm
[J].
Aquilanti, V
;
Cavalli, S
;
Simoni, A
;
Aguilar, A
;
Lucas, JM
;
De Fazio, D
.
JOURNAL OF CHEMICAL PHYSICS,
2004, 121 (23)
:11675-11690

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Simoni, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

De Fazio, D
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[6]
Hyperquantization algorithm. I. Theory for triatomic systems
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
.
JOURNAL OF CHEMICAL PHYSICS,
1998, 109 (10)
:3792-3804

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

论文数: 引用数:
h-index:
机构:
[7]
The He+H2+ reaction:: a dynamical test on potential energy surfaces for a system exhibiting a pronounced resonance pattern
[J].
Aquilanti, V
;
Capecchi, G
;
Cavalli, S
;
De Fazio, D
;
Palmieri, P
;
Puzzarini, C
;
Aguilar, A
;
Giménez, X
;
Lucas, JM
.
CHEMICAL PHYSICS LETTERS,
2000, 318 (06)
:619-628

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Capecchi, G
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

论文数: 引用数:
h-index:
机构:

Palmieri, P
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Puzzarini, C
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Giménez, X
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[8]
Reactivity enhanced by under-barrier tunneling and resonances:: the F+H2→HF+H reaction
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Volpi, A
;
Aguilar, A
;
Giménez, X
;
Lucas, JM
.
CHEMICAL PHYSICS LETTERS,
2003, 371 (3-4)
:504-509

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

论文数: 引用数:
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机构:

Volpi, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Giménez, X
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[9]
Exact reaction dynamics by the hyperquantization algorithm:: integral and differential cross sections for F+H2, including long-range and spin orbit effects
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Volpi, A
;
Aguilar, A
;
Giménez, X
;
Lucas, JM
.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS,
2002, 4 (03)
:401-415

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

论文数: 引用数:
h-index:
机构:

Volpi, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Giménez, X
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy
[10]
Hyperquantization algorithm.: II.: Implementation for the F+H2 reaction dynamics including open-shell and spin-orbit interactions
[J].
Aquilanti, V
;
Cavalli, S
;
De Fazio, D
;
Volpi, A
;
Aguilar, A
;
Giménez, X
;
Lucas, JM
.
JOURNAL OF CHEMICAL PHYSICS,
1998, 109 (10)
:3805-3818

Aquilanti, V
论文数: 0 引用数: 0
h-index: 0
机构:
Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Cavalli, S
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

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机构:

Volpi, A
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h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Aguilar, A
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Giménez, X
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy

Lucas, JM
论文数: 0 引用数: 0
h-index: 0
机构: Univ Perugia, Dipartimento Chim, I-06123 Perugia, Italy