MICROSCOPIC THEORY OF SOLVATION DYNAMICS IN DIPOLAR LIQUIDS

被引：49

作者：

CHANDRA, A

WEI, DQ

PATEY, GN

机构：

[1] Department of Chemistry, University of British Columbia, Vancouver

[2] Centre de Recherche en Calcul Applique, Montreal, Que. H3X 2H9, 5160 boul. Decarie

来源：

JOURNAL OF CHEMICAL PHYSICS | 1993年 / 99卷 / 07期

关键词：

D O I：

10.1063/1.466041

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

A self contained microscopic theory is described for ion solvation dynamics in dipolar fluids. The theory takes account of inertial and non-Markovian effects which are of critical importance for the fast initial phase of the relaxation of the ion-solvent energy. The theory also includes diffusional effects important at long times. The results obtained are shown to be in good agreement with recent computer simulation studies of ions in Stockmayer solvents.

引用

页码：4926 / 4931

页数：6

共 27 条

[1]

[Anonymous], ADV CHEM PHYS

[2] DYNAMICS OF SOLVATION AND CHARGE-TRANSFER REACTIONS IN DIPOLAR LIQUIDS [J].

BAGCHI, B .

ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1989, 40 :115-141

[3] ULTRAFAST SOLVATION DYNAMICS - MOLECULAR EXPLANATION OF COMPUTER-SIMULATION RESULTS IN A SIMPLE DIPOLAR SOLVENT [J].

BAGCHI, B ;

CHANDRA, A .

JOURNAL OF CHEMICAL PHYSICS, 1992, 97 (07) :5126-5131

[4]

Barbara P. F., 1990, ADV PHOTOCHEM, V15, P1, DOI DOI 10.1002/9780470133453.CHL

[5] EFFECTS OF SOLVENT VISCOELASTICITY IN THE SOLVATION DYNAMICS OF AN ION IN A DENSE DIPOLAR LIQUID [J].

CHANDRA, A ;

BAGCHI, B .

CHEMICAL PHYSICS, 1991, 156 (03) :323-338

[6]

CHANDRA A, IN PRESS J CHEM PHYS

[7] ULTRAFAST SOLVENT DYNAMICS - CONNECTION BETWEEN TIME RESOLVED FLUORESCENCE AND OPTICAL KERR MEASUREMENTS [J].

CHO, MH ;

ROSENTHAL, SJ ;

SCHERER, NF ;

ZIEGLER, LD ;

FLEMING, GR .

JOURNAL OF CHEMICAL PHYSICS, 1992, 96 (07) :5033-5038

[8]

DELEEUW SW, 1986, ANNU REV PHYS CHEM, V37, P245, DOI 10.1146/annurev.pc.37.100186.001333

[9]

DELEEUW SW, 1983, P ROY SOC LOND A MAT, V388, P177, DOI 10.1098/rspa.1983.0077

[10] SIMULATION OF ELECTROSTATIC SYSTEMS IN PERIODIC BOUNDARY-CONDITIONS .1. LATTICE SUMS AND DIELECTRIC-CONSTANTS [J].

DELEEUW, SW ;

PERRAM, JW ;

SMITH, ER .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, 1980, 373 (1752) :27-56

← 1 2 3 →