PREDICTION OF THE VIBRATIONAL-SPECTRA OF INTERACTING WATER-MOLECULES

被引：35

作者：

CHIN, S ^{[1
]}

FORD, TA ^{[1
]}

PERSON, WB ^{[1
]}

机构：

[1] UNIV WITWATERSRAND,DEPT CHEM,JOHANNESBURG 2001,SOUTH AFRICA

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1984年 / 113卷 / MAR期

关键词：

D O I：

10.1016/0022-2860(84)80156-8

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：341 / 358

页数：18

共 25 条

[1]

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

[2] CNDO CALCULATION OF DIPOLE-MOMENT DERIVATIVES AND INFRARED INTENSITIES OF BF3 [J].

BRUNS, R ;

PERSON, WB .

JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (11) :5401-&

[3] CNDO CALCULATION OF DIPOLE-MOMENT DERIVATIVES AND INFRARED INTENSITIES OF FORMALDEHYDE [J].

BRUNS, RE ;

PERSON, WB .

JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (06) :2585-2592

[4] CNDO CALCULATION OF DIPOLE-MOMENT DERIVATIVES AND INFRARED INTENSITIES OF C6H6 AND C6F6 [J].

BRUNS, RE ;

PERSON, WB .

JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (01) :324-&

[5]

CHIN S, UNPUB J PHYS CHEM

[6]

CHIN SA, UNPUB

[7]

COOK CM, 1981, QCPE, V13, P391

[8] AB-INITIO CALCULATION OF VIBRATIONAL FORCE-FIELD OF WATER DIMER [J].

CURTISS, LA ;

POPLE, JA .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1975, 55 (1-3) :1-14

[9] EFFECTIVE ATOMIC CHARGE MODEL FOR INFRARED INTENSITIES [J].

DECIUS, JC .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1975, 57 (03) :348-362

[10] ATOMIC POLAR TENSORS AND EFFECTIVE CHARGE-CHARGE FLUX MODEL OF INFRARED INTENSITIES [J].

DECIUS, JC ;

MAST, GB .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1978, 70 (02) :294-306

← 1 2 3 →