On the influence of non-additive interactions on the optical properties of the selected subsystems of crystalline urea

被引：18

作者：

Skwara, B ^{[1
]}

Gora, RW ^{[1
]}

Bartkowiak, W ^{[1
]}

机构：

[1] Wroclaw Univ Technol, Inst Phys & Theoret Chem, Dept Chem, PL-50370 Wroclaw, Poland

来源：

CHEMICAL PHYSICS LETTERS | 2005年 / 406卷 / 1-3期

关键词：

D O I：

10.1016/j.cplett.2005.02.086

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：

The results of many-body analysis of the intermolecular interaction energy for the selected subsystems of the molecular crystal of urea are discussed. In particular, a great importance of cooperative effects in both, the interaction energy and linear and non-linear optical properties are considered. The nature of intermolecular interactions in the urea clusters is investigated applying the hybrid variational-perturbational interaction energy decomposition scheme. Molecular polarizabilities and first-order hyperpolarizabilities are estimated by means of a finite-field technique combined with the Hartree-Fock and the second-order Moller Plesset perturbation theories. The results of our calculations indicate a substantial influence of the many-body effects on the non-linear response of the studied hydrogen-bonded systems. (c) 2005 Elsevier B.V. All rights reserved.

引用

页码：29 / 37

页数：9

共 50 条

[21] Influence of Temperature on the Rheological Behavior of Non-additive Olive oil [J].

Stanciu, Ioana .

ORIENTAL JOURNAL OF CHEMISTRY, 2022, 38 (01) :106-109

[22] Better together: Non-additive interactions between schizophrenia risk genes [J].

Deans, P. J. Michael ;

Brennand, Kristen J. .

CELL GENOMICS, 2023, 3 (09)

[23] THERMODYNAMIC BEHAVIOR OF A SIMPLE LIQUID - MFA WITH NON-ADDITIVE LATERAL INTERACTIONS [J].

MILCHEV, A ;

GUTZOW, I .

PHYSICS AND CHEMISTRY OF LIQUIDS, 1981, 11 (01) :25-45

[24] NON-ADDITIVE INTERMOLECULAR POTENTIAL IN GASES .1. VANDERWAALS INTERACTIONS [J].

MIDZUNO, Y ;

KIHARA, T .

JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, 1956, 11 (10) :1045-1049

[25] The adsorption of a mixture of particles with non-additive interactions: a Monte Carlo study [J].

Pinto, O. A. ;

Pasinetti, P. M. ;

Ramirez-Pastorb, A. J. ;

Nieto, F. D. .

PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2015, 17 (05) :3050-3058

[26] Phase transitions in systems with non-additive long-range interactions [J].

Mori, Takashi .

JOURNAL OF STATISTICAL MECHANICS-THEORY AND EXPERIMENT, 2013,

[27] Some relations among values, interactions, and decomposability of non-additive measures [J].

Fujimoto, Katsushige ;

Murofushi, Toshiaki .

INTERNATIONAL JOURNAL OF UNCERTAINTY FUZZINESS AND KNOWLEDGE-BASED SYSTEMS, 2007, 15 (02) :175-191

[28] Non-additive properties of finite 1D Ising chains with long-range interactions [J].

Apostolov, S. S. ;

Mayzelis, Z. A. ;

Usatenko, O. V. ;

Yampol'skii, V. A. .

JOURNAL OF PHYSICS A-MATHEMATICAL AND THEORETICAL, 2009, 42 (09)

[29] MOLECULAR-DYNAMICS IN STUDYING EFFECT OF NON-ADDITIVE MOLECULAR-INTERACTIONS ON THERMODYNAMIC PROPERTIES OF MIXTURES [J].

TSYKALO, AL ;

DOROSHENKO, ZF .

ZHURNAL TEKHNICHESKOI FIZIKI, 1976, 46 (10) :2227-2229

[30] Weak specification properties and large deviations for non-additive potentials [J].

Varandas, Paulo ;

Zhao, Yun .

ERGODIC THEORY AND DYNAMICAL SYSTEMS, 2015, 35 :968-993

← 1 2 3 4 5 →