Steric and energetic properties of the Cl--C6H6-Arn heterocluster

被引：29

作者：

Albertí, M

Castro, A

Laganà, A

Moix, M

Pirani, F

Cappelletti, D

机构：

[1] Univ Barcelona, Dept Quim Fis, CERQT, E-08028 Barcelona, Spain

[2] Univ Perugia, Dipartimento Chim, I-0123 Perugia, Italy

[3] Univ Perugia, Dipartimento Ingn Civile & Ambientale, I-0123 Perugia, Italy

[4] Ist Nazl Fis Nucl, Unita Perugia, I-0123 Perugia, Italy

来源：

EUROPEAN PHYSICAL JOURNAL D | 2006年 / 38卷 / 01期

关键词：

D O I：

10.1140/epjd/e2005-00303-6

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

The dynamics of heteroclusters containing argon, benzene and chlorine has been investigated using a recently proposed potential energy functional that takes into account both the electrostatic and the non-electrostatic contributions to the overall noncovalent interaction. Related steric and energetic properties are compared with those homologous cationic clusters.

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收藏

页码：185 / 191

页数：7

相关论文

共 43 条

[1] A molecular dynamics investigation of rare-gas solvated cation-benzene clusters using a new model potential [J].

Albertí, M ;

Castro, A ;

Laganà, A ;

Moix, M ;

Pirani, F ;

Cappelletti, D ;

Liuti, G .

JOURNAL OF PHYSICAL CHEMISTRY A, 2005, 109 (12) :2906-2911

[2] Properties of an atom-bond additive representation of the interaction for benzene-argon clusters [J].

Albertí, M ;

Castro, A ;

Laganà, A ;

Pirani, F ;

Porrini, M ;

Cappelletti, D .

CHEMICAL PHYSICS LETTERS, 2004, 392 (4-6) :514-520

[3] Weak C-H•••O and C-H•••F-C hydrogen bonds in the oxirane-trifluoromethane dimer [J].

Alonso, JL ;

Antolínez, S ;

Blanco, S ;

Lesarri, A ;

López, JC ;

Caminati, W .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2004, 126 (10) :3244-3249

[4] Glory-scattering measurement of water-noble-gas interactions: The birth of the hydrogen bond [J].

Aquilanti, V ;

Cornicchi, E ;

Teixidor, MM ;

Saendig, N ;

Pirani, F ;

Cappelletti, D .

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2005, 44 (16) :2356-2360

[5]

Beer PD, 2001, ANGEW CHEM INT EDIT, V40, P486, DOI 10.1002/1521-3773(20010202)40:3<486::AID-ANIE486>3.3.CO

[6]

2-G

[7] Dynamics and energy release in benzene/Ar cluster dissociation [J].

Bernshtein, V ;

Oref, I .

JOURNAL OF CHEMICAL PHYSICS, 2000, 112 (02) :686-697

[8] INTERMOLECULAR DYNAMICS OF BENZENE RARE-GAS COMPLEXES AS DERIVED FROM MICROWAVE-SPECTRA [J].

BRUPBACHER, T ;

MAKAREWICZ, J ;

BAUDER, A .

JOURNAL OF CHEMICAL PHYSICS, 1994, 101 (11) :9736-9746

[9] Size selectivity by cation-π interactions:: Solvation of K+ and Na+ by benzene and water [J].

Cabarcos, OM ;

Weinheimer, CJ ;

Lisy, JM .

JOURNAL OF CHEMICAL PHYSICS, 1999, 110 (17) :8429-8435

[10] Competitive solvation of K+ by benzene and water:: Cation-π interactions and π-hydrogen bonds [J].

Cabarcos, OM ;

Weinheimer, CJ ;

Lisy, JM .

JOURNAL OF CHEMICAL PHYSICS, 1998, 108 (13) :5151-5154

← 1 2 3 4 5 →