EXTENDED HUCKEL AND EMPIRICAL FORCE-FIELD CALCULATIONS FOR CHEMISORPTION ON METAL-SURFACES

被引：0

作者：

SIMONETTA, M ^{[1
]}

GAVEZZOTTI, A ^{[1
]}

机构：

[1] CNR CTR, I-20133 MILANO, ITALY

来源：

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1984年 / 16卷 / FEB期

关键词：

D O I：

暂无

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：75 / 86

页数：12

共 50 条

[41] Why does spontaneous resolution take place? (Empirical force-field calculations)
Nakajima, M
Konno, T
Yoshikawa, Y
JOURNAL OF COORDINATION CHEMISTRY, 2004, 57 (08) : 641 - 645
[42] EMPIRICAL FORCE-FIELD CALCULATIONS ON TETRAARYLMETHANES AND TETRAARYLSILANES .1. STATIC STEREOCHEMISTRY
HUTCHINGS, MG
ANDOSE, JD
MISLOW, K
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (16) : 4553 - 4561
[43] ANDROSTERONE - STRUCTURE BY FORCE-FIELD CALCULATIONS
ALLINGER, NL
TRIBBLE, MT
YUH, Y
STEROIDS, 1975, 26 (04) : 398 - 406
[44] ITERATIVE FORCE-FIELD CALCULATIONS OF CYCLODECANONE
RAWDAH, TN
TETRAHEDRON, 1989, 45 (23) : 7405 - 7410
[45] Empirical force-field and ab initio calculations on delocalized open chain cations
Reindl, B
Clark, T
Schleyer, PV
JOURNAL OF COMPUTATIONAL CHEMISTRY, 1997, 18 (01) : 28 - 44
[46] STRUCTURE AND DYNAMIC STEREOCHEMISTRY OF TRIMESITYLMETHANE .2. EMPIRICAL FORCE-FIELD CALCULATIONS
ANDOSE, JD
MISLOW, K
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (07) : 2168 - 2176
[47] EMPIRICAL FORCE-FIELD CALCULATIONS ON TETRAARYLMETHANES AND TETRARRYLSILANES .2. DYNAMIC STEREOCHEMISTRY
HUTCHINGS, MG
ANDOSE, JD
MISLOW, K
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (16) : 4562 - 4570
[48] APPLICATION OF EMPIRICAL FORCE-FIELD CALCULATIONS TO INTERNAL DYNAMICS IN 9-BENZYLTRIPTYCENES
NACHBAR, RB
HOUNSHELL, WD
NAMAN, VA
WENNERSTROM, O
GUENZI, A
MISLOW, K
JOURNAL OF ORGANIC CHEMISTRY, 1983, 48 (08): : 1227 - 1232
[49] INDUCTION FORCE BETWEEN METAL-SURFACES
FORD, GW
WEBER, WH
BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1980, 25 (03): : 293 - 293
[50] EMPIRICAL FORCE-FIELD CALCULATIONS .11. THE IMPLEMENTATION OF CONSTRAINTS IN MOLECULAR MECHANICS TO EXPLORE POTENTIAL-ENERGY SURFACES
VANDEGRAAF, B
BAAS, JMA
RECUEIL DES TRAVAUX CHIMIQUES DES PAYS-BAS-JOURNAL OF THE ROYAL NETHERLANDS CHEMICAL SOCIETY, 1980, 99 (10): : 327 - 328

← 1 2 3 4 5 →