DIRECTED-GRAPHS OF STRUCTURALLY STABLE POTENTIAL-ENERGY SURFACES REPRESENTING A-PRIORI REACTION PATHWAYS

被引：17

作者：

FERNANDEZ, A

SINANOGLU, O

机构：

来源：

THEORETICA CHIMICA ACTA | 1984年 / 65卷 / 03期

关键词：

D O I：

10.1007/BF00551331

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

收藏

页码：179 / 190

页数：12

相关论文

共 19 条

[1]

ADRONOV AA, 1937, DOKL AKAD NAUK SSSR+, V14, P247

[2]

Born M, 1927, ANN PHYS-BERLIN, V84, P0457

[3] STUDY OF MECHANISM OF COPE REARRANGEMENT [J].

DEWAR, MJS ;

WADE, LE .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (13) :4417-4424

[4]

FERNANDEZ A, 1984, UNPUB J MATH PHY FEB

[5] A FORMULATION OF REACTION COORDINATE [J].

FUKUI, K .

JOURNAL OF PHYSICAL CHEMISTRY, 1970, 74 (23) :4161-&

[6] SUBSTITUENT EFFECTS IN CONCERTED REACTIONS - NON-LINEAR FREE-ENERGY RELATIONSHIP FOR THE 3,3-SHIFT AND THE DIELS-ALDER REACTION [J].

GAJEWSKI, JJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (15) :4393-4394

[7]

Glasstone S, 1941, THEORY RATE PROCESSE

[8]

HEHRE W, 1977, ELECTRONIC STRUCTURE, V3, P223

[9]

KRASNOSELSKII N, 1966, PLANE VECTOR FIELDS

[10]

Kupka I., 1963, CONTRIB DIFFERENTIAL, V2, P457