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

被引：335

作者：

BLOM, CE ^{[1
]}

ALTONA, C ^{[1
]}

机构：

[1] UNIV LEIDEN GORLAEUS LABS,DEPT ORG CHEM,LEIDEN,NETHERLANDS

来源：

MOLECULAR PHYSICS | 1976年 / 31卷 / 05期

关键词：

D O I：

10.1080/00268977600101081

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：1377 / 1391

页数：15

共 15 条

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[2]

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[9] STUDY ON VIBRATION-SPECTRA OF PROPANE CD3-CH2-CD3 AND REMARK ON VIBRATION FREQUENCY OF SYMMETRICAL VALENCE OF CH2 AND CH3 GROUPS [J].

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[10] CH BOND LENGTHS AND STRENGTHS, UNPERTURBED CH STRETCHING FREQUENCIES, FROM PARTIAL DEUTERATION INFRARED STUDIES - TERT-BUTYL COMPOUNDS AND PROPANE [J].

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