APPLICATION OF THE MNDO/HB METHOD FOR CALCULATING SYSTEMS WITH PROTON-TRANSFER IN HYDROGEN-BONDS

被引：1

|

作者：

BURSHTEIN, KY

ISAEV, AN

机构：

来源：

JOURNAL OF STRUCTURAL CHEMISTRY | 1986年 / 27卷 / 03期

关键词：

D O I：

10.1007/BF00751806

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

引用

收藏

页码：347 / 351

页数：5

相关论文

共 50 条

[1] INFLUENCE OF ENVIRONMENT ON PROTON-TRANSFER IN SYMMETRICAL HYDROGEN-BONDS
WEIDEMANN, EG
ZUNDEL, G
[J]. ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES, 1973, A 28 (02): : 236 - 245
[2] PROTON-TRANSFER IN HYDROGEN-BONDS - A SIMPLE-MODEL
KIEFER, PM
LEITE, VBP
WHITNELL, RM
[J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1995, 210 : 113 - PHYS
[3] MODIFICATION OF THE MNDO METHOD FOR CALCULATIONS FOR SYSTEMS WITH HYDROGEN-BONDS
BURSHTEIN, KY
ISAEV, AN
[J]. JOURNAL OF STRUCTURAL CHEMISTRY, 1984, 25 (01) : 21 - 25
[4] VARIATION OF ATOMIC CHARGES DURING PROTON-TRANSFER IN HYDROGEN-BONDS
FLORIAN, J
SCHEINER, S
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1994, 15 (05) : 553 - 560
[5] COMPUTATION OF PROTON-TRANSFER RATES IN BENT AND LINEAR HYDROGEN-BONDS
SCHEINER, S
[J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1993, 206 : 249 - PHYS
[6] MODELING PROTON-TRANSFER POTENTIALS IN ANGULARLY DEFORMED HYDROGEN-BONDS
DUAN, XF
SCHEINER, S
WANG, RS
[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1993, : 77 - 87
[7] SYMMETRY OF HYDROGEN-BONDS, INFRARED CONTINUOUS ABSORPTION AND PROTON-TRANSFER
LINDEMANN, R
ZUNDEL, G
[J]. JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1972, 68 (06): : 979 - +
[8] THIOPHENOL N-BASE HYDROGEN-BONDS - PROTON POLARIZABILITY AND PROTON-TRANSFER WITHIN THESE BONDS
ALBRECHT, G
ZUNDEL, G
[J]. CHEMICAL PHYSICS LETTERS, 1984, 105 (06) : 598 - 603
[9] MNDO CALCULATIONS OF SYSTEMS CONTAINING HYDROGEN-BONDS
VOITYUK, AA
BLIZNYUK, AA
[J]. THEORETICA CHIMICA ACTA, 1987, 72 (03): : 223 - 228
[10] COMPLEXES WITH HYDROGEN-BONDS BY THE MNDO/M METHOD
BLIZNYUK, AA
VOITYUK, AA
[J]. JOURNAL OF STRUCTURAL CHEMISTRY, 1988, 29 (02) : 192 - 197

← 1 2 3 4 5 →