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Volume 6; Issue 4-5
Main
Structural Chemistry
Volume 6; Issue 4-5
Structural Chemistry
Volume 6; Issue 4-5
1
Foreword
Jerzy Leszczyński
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 43 KB
Your tags:
english, 1995
2
Calculated structures and heats of formation of some predicted C, N, O, F molecules
Peter Politzer
,
Pat Lane
,
Per Sjoberg
,
M. Edward Grice
,
Harold Shechter
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 361 KB
Your tags:
english, 1995
3
The aromatic diboracyclopropenyl (diboriranyl) anion; CB2H3−: An ab initio study
A. A. Korkin
,
P. v. R. Schleyer
,
U. v. Arx
,
R. Keese
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 275 KB
Your tags:
english, 1995
4
Some recent applications of ab initio electronic structure methods to metal, semimetal, and molecular clusters
R. C. Binning
,
Yasuyuki Ishikawa
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 1.18 MB
Your tags:
english, 1995
5
Theoretical investigation of isotopic scrambling mechanisms in 2-chloroethyl methyl sulfide
William H. Donovan
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 917 KB
Your tags:
english, 1995
6
Ab initio investigation on stability and properties of XYCO... HZ complexes. II: Post hartree-fock studies on H2CO... HF
Andrzej Nowek
,
Jerzy Leszczyński
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 324 KB
Your tags:
english, 1995
7
Shape analysis of macromolecular electron densities
Paul G. Mezey
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 861 KB
Your tags:
english, 1995
8
A theoretical study of some steps in the Wacker process
Per E. M. Siegbahn
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 774 KB
Your tags:
english, 1995
9
Tautomerism of xanthine: The second-order MØller-Plesset study
Jiři šponer
,
Jerzy Leszczyński
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 389 KB
Your tags:
english, 1995
10
Intermolecular interaction energy of CH4trimer by symmetry-adapted perturbation theory
Masanori Tachikawa
,
Kazunari Suzuki
,
Kaoru Iguchi
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 420 KB
Your tags:
english, 1995
11
Ab initio studies of methylenecarbene and isoelectronic species
Hallie K. Brody
,
David H. Magers
,
Jerzy Leszczyński
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 574 KB
Your tags:
english, 1995
12
The statistical generation of SCS values and interaction factors for the13C NMR spectra of arenes
R. E. Jetton
,
J. R. Nanney
,
C. A. L. Mahaffy
,
C. C. Price
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 954 KB
Your tags:
english, 1995
13
Self-consistent relativistic effective core potentials for transition metal atoms: Cu, Ag, and Au
A. V. Titov
,
N. S. Mosyagin
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 289 KB
Your tags:
english, 1995
14
Ab initio studies of peroxynitrite anion-water complexes
Hui-Hsu Tsai
,
Tracy P. Hamilton
,
Jyh-Hsin M. Tsai
,
Joseph S. Beckman
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 680 KB
Your tags:
english, 1995
15
Bond functions and the topological properties of the bonds
Anibal Sierraalta
,
Mirixa Boves
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 403 KB
Your tags:
english, 1995
16
Ab initio predictions of the molecular structures and harmonic vibrational frequencies of Ga2O2isomers
Edet F. Archibong
,
Richard Sullivan
,
Jerzy Leszczyński
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 291 KB
Your tags:
english, 1995
17
Interaction of divalent metal cations and nucleotides: A computational study
T. Varnali
,
D. Tözüm-çalgan
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 404 KB
Your tags:
english, 1995
18
A theoretical study for the structure of propranolol and some fluorinated derivatives
Zarreen H. Farooqi
,
Hassan Y. Aboul-Enein
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 498 KB
Your tags:
english, 1995
19
Using theoretical descriptors in quantitative structure-activity relationships: HPLC capacity factors for energetic materials
Alfred H. Lowrey
,
George R. Famini
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 592 KB
Your tags:
english, 1995
20
Book reviews
Colin J. Marsden
,
Arthur Greenberg
,
Magdolna Hargittai
Journal:
Structural Chemistry
Year:
1995
Language:
english
File:
PDF, 414 KB
Your tags:
english, 1995
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