ABINITIO CALCULATIONS OF RAMAN INTENSITIES - ANALYSIS OF THE BOND POLARIZABILITY APPROACH AND THE ATOM DIPOLE INTERACTION-MODEL

被引：40

作者：

VANHEMERT, MC ^{[1
]}

BLOM, CE ^{[1
]}

机构：

[1] SWISS FED INST TECHNOL,PHYS CHEM LAB,CH-8092 ZURICH,SWITZERLAND

来源：

MOLECULAR PHYSICS | 1981年 / 43卷 / 01期

关键词：

D O I：

10.1080/00268978100101301

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：

引用

页码：229 / 250

页数：22

共 48 条

[1] POLARIZABILITIES OF CH AND CC BONDS [J].

AMOS, AT ;

CRISPIN, RJ .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (05) :1890-1899

[2] CALCULATION OF RAMAN-SCATTERING PARAMETERS FOR METHANE AND HALOMETHANES FROM AN ATOM DIPOLE INTERACTION-MODEL [J].

APPLEQUIST, J ;

QUICKSALL, CO .

JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (08) :3455-3459

[3]

APPLEQUIST J, 1972, J AM CHEM SOC, V94, P295

[4]

BIARGE JF, 1961, AN SOC ESP FIS QUIM, V57A, P81

[5] STUDY ON GVFF OF CHF3, CH2F2, AND CH3F [J].

BLOM, CE ;

MULLER, A .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1978, 70 (03) :449-458

[6] APPLICATION OF SELF-CONSISTENT-FIELD AB-INITIO CALCULATIONS TO ORGANIC-MOLECULES .2. SCALE FACTOR METHOD FOR CALCULATION OF VIBRATIONAL FREQUENCIES FROM AB-INITIO FORCE CONSTANTS - ETHANE, PROPANE AND CYCLOPROPANE [J].

BLOM, CE ;

ALTONA, C .

MOLECULAR PHYSICS, 1976, 31 (05) :1377-1391

[7]

CHANTRY GW, 1979, RAMAN EFFECT, P49

[8] COMPUTATION OF LARGE MOLECULES WITH HARTREE-FOCK MODEL [J].

CLEMENTI, E .

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 1972, 69 (10) :2942-&

[9] ELECTRIC DIPOLE POLARIZABILITY OF ATOMS BY HARTREE-FOCK METHOD .I. THEORY FOR CLOSED-SHELL SYSTEMS [J].

COHEN, HD ;

ROOTHAAN, CC .

JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (10) :S034-+

[10] VIBRATIONAL INTENSITIES .2. THE USE OF ISOTOPES [J].

CRAWFORD, B .

JOURNAL OF CHEMICAL PHYSICS, 1952, 20 (06) :977-981

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