EFFECT OF HYDROGEN-BONDING ON STRUCTURAL PARAMETERS .4. ABINITIO STUDY OF FORMAMIDE-AMMONIA COMPLEXES

被引：7

作者：

OTTERSEN, T

JENSEN, HH

JOHANSEN, R

WISLOFFNILSSEN, E

机构：

[1] UNIV OSLO,DEPT PHARM,OSLO 3,NORWAY

[2] UNIV TROMSO,INST MATH & PHYS SCI,9000 TROMSO,NORWAY

[3] UNIV OSLO,DEPT CHEM,OSLO 3,NORWAY

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1976年 / 30卷 / 02期

关键词：

D O I：

10.1016/0022-2860(76)87014-7

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：379 / 387

页数：9

共 8 条

[1]

ALMLOF J, 1972, USIP7209 U STOCKH RE

[2] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS [J].

DUNNING, TH .

JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (07) :2823-+

[3] COMPARATIVE AB-INITIO STUDY OF SOME MOLECULAR SYSTEMS BASED ON HYDRAZINE AND FORMAMIDE [J].

OTTERSEN, T ;

JENSEN, HH .

JOURNAL OF MOLECULAR STRUCTURE, 1975, 26 (02) :355-363

[4] EFFECT OF HYDROGEN-BONDING ON STRUCTURAL PARAMETERS .2. AB-INITIO STUDY OF MONOHYDRATED FORMAMIDE MOLECULE [J].

OTTERSEN, T ;

JENSEN, HH .

JOURNAL OF MOLECULAR STRUCTURE, 1975, 26 (02) :375-385

[5] EFFECT OF HYDROGEN-BONDING ON STRUCTURAL PARAMETERS .1. AB-INITIO STUDY OF KETO AND ENOL TAUTOMERS OF FORMAMIDE AND THEIR HYDROGEN-BONDED DIMERS [J].

OTTERSEN, T .

JOURNAL OF MOLECULAR STRUCTURE, 1975, 26 (02) :365-374

[6]

OTTERSEN T, 1975, J MOL STRUCT, V28, P220

[7] CAUSSIAN BASIS SETS FOR FIRST AND SECOND ROW ATOMS [J].

ROOS, B ;

SIEGBAHN, P .

THEORETICA CHIMICA ACTA, 1970, 17 (03) :209-&

[8]

TALBERG HJ, TO BE PUBLISHED

← 1 →