hrcak mascot   Srce   HID

Croatica Chemica Acta, Vol. 57 No. 5, 1984.


Croatica Chemica Acta,Vol. 57 No. 5
Datum izdavanja: siječanj 1985.

Objavljen na Hrčku: 26. 2. 2018.
Sadržaj Puni tekst
Prologue (str.I-III) engleskipdf 1 MB
Zvonimir B. Maksić
Uvodnik
 
Abstracts and Contents (str.IV-XIV) engleskipdf 4 MB
Kazalo  
Hybrid Bond Orbitals and Bond Strengths for Pentacovalent Bonding (str.765-778) engleskipdf 6 MB
Zelek S. Herman, Linus Pauling
Izvorni znanstveni članak
 
On Determining Orbital Hybridization (str.779-786) engleskipdf 4 MB
William E. Palke
Izvorni znanstveni članak
 
In Situ Atomic Orbitals and Extended Basis Molecular Calculations (str.787-800) engleskipdf 7 MB
Giuseppe Del Re, Claudette Barbier
Izvorni znanstveni članak
 
Structure and Properties of Small Ring Propellanes by the IMO Method (str.801-810) engleskipdf 8 MB
Dragan Lj. Vučković, Ljubica Vujisić
Izvorni znanstveni članak
 
A Localized Atomic Orbital Description of the Rotational Barrier in Ethane (str.811-831) engleskipdf 19 MB
Keith H. Aufderheide
Izvorni znanstveni članak
 
The Representation of the Chemical Bond in Quantum Chemical Calculations (str.833-854) engleskipdf 18 MB
Peter R. Surjan
Pregledni rad
 
Many-Body Perturbation Theory Based on Localized Orbitals (str.855-864) engleskipdf 8 MB
Ede Kapuy, Zoltan Csepes, Cornelia Kozmutza
Izvorni znanstveni članak
 
Weak Interactions Between Molecules (str.865-878) engleskipdf 12 MB
Roy McWeeny
Izvorni znanstveni članak
 
On the Stability of BHJ and BFJ Adducts with BF, CO and N2 (str.879-886) engleskipdf 7 MB
Amelia Garcia-Leigh, John N. Murrell
Izvorni znanstveni članak
 
Fragment Molecular Orbitals for Molecules and Interacting Systems (str.887-899) engleskipdf 14 MB
Martin Klessinger
Pregledni rad
 
Chemical Fragmentation for Molecular Orbital Calculations on Proteins (str.901-910) engleskipdf 10 MB
Gabor Naray-Szabo
Izvorni znanstveni članak
 
A Quantitative Analysis of the Role of Non-Bonded and Geminal Interactions in H2N-X Molecules (str.911-925) engleskipdf 13 MB
Fernando Bernardi, Andrea Bottoni, Glauco Tonachini
Izvorni znanstveni članak
 
Do the VSEPR Points-on-a-Sphere Repulsions Simulate Quantum Interactions? (str.927-939) engleskipdf 14 MB
Lawrence S. Bartell
Izvorni znanstveni članak
 
Bond Order as a Tool for Molecular Structure and Reactivity (str.941-953) engleskipdf 13 MB
Karl Jug
Pregledni rad
 
Nonbonded Bond Orders, Molecular Conformations, and Relative Stabilities of Sulfur-Nitrogen Rings and Chains (str.955-965) engleskipdf 4 MB
Benjamin M. Gimarc
Izvorni znanstveni članak
 
The Equivalent Bond Orbital Model Revisited: I. Orbitals, Orbital Energies and PE Spectra of Saturated Hydrocarbons (str.967-990) engleskipdf 8 MB
Evi Honegger, Zhong-zhi Yang, Edgar Heilbronner
Izvorni znanstveni članak
 
Breakdown of the One-Electron Picture of Ionization for Hydrocarbon n Systems (str.991-1010) engleskipdf 8 MB
Jens Spanget-Larsen
Izvorni znanstveni članak
 
An Overlapping Spheres Multiple Scattering Xa Study of the Perfluoro Effect on the Ionisation Potentials and Electron Transmission Spectra of Fluorosubstituted Benzenes (str.1011-1030) engleskipdf 13 MB
John E. Bloor, Ronald E. Sherrod
Izvorni znanstveni članak
 
»Common Denominators« by the MOVB Method: The Structures of H20, H202, and Their Derivatives (str.1031-1053) engleskipdf 13 MB
Nicolaos D. Epiotis, James R. Larson, Hugh H. Eaton
Izvorni znanstveni članak
 
Some Observations Concerning Electronic Densities, Electrostatic Potentials and Chemical Potentials (str.1055-1064) engleskipdf 5 MB
Peter Politzer, Barbara A. Zilles
Izvorni znanstveni članak
 
The Molecular Electrostatic Potential as a Determinant of Receptor-Drug Recognition (str.1065-1074) engleskipdf 7 MB
Dušan Hadži, Milan Hodošček, Darko Kocjan, Tomaž Šolmajer, Franc Avbelj
Izvorni znanstveni članak
 
Symmetry Adaptation and Wigner-Racah Algebras in Quantum Chemistry (str.1075-1095) engleskipdf 18 MB
Maurice Kibler
Pregledni rad
 
The E ® E Jahn-Teller Coupling: Models and Manifestations (str.1097-1106) engleskipdf 6 MB
Carl J. Ballhausen
Pregledni rad
 
Derivation of the AOM Parameterization from the Effective Hamiltonian for Complexed Transition Metal Ions with Application to Effectively Tetragonal Four-Coordinate Systems (str.1107-1124) engleskipdf 11 MB
Marion L. Ellzey
Izvorni znanstveni članak
 
The Applicability of Point-Charge Approximations to the Calculation of Molecular Expectation Values (str.1125-1144) engleskipdf 14 MB
Michael Grodzicki
Izvorni znanstveni članak
 
Infrared Band Intensities, Electric Charge Distribution in Molecules and Polar Properties of Valence Bonds (str.1145-1164) engleskipdf 17 MB
Boris Galabov, Bogdana Nikolova, William J. Orville-Thomas
Pregledni rad
 
Homoconjugation in Radical Cations (str.1165-1176) engleskipdf 10 MB
Robert C. Haddon, Heinz D. Roth
Izvorni znanstveni članak
 
A Theoretical Study of the 1H-Chemical Shifts of [4n]- and [4n + 2]-Annulenes and their Di- and Tetraanions (str.1177-1191) engleskipdf 13 MB
Helmut Vogler
Izvorni znanstveni članak
 
The Method of Moments and the Energy Levels of Molecules and Solids (str.1193-1216) engleskipdf 16 MB
Jeremy K. Burdett, Stephen Lee, William C. Sha
Izvorni znanstveni članak
 
Conformational Analysis of Bis-(N,N-Dimethylisoleucinato)copper(II): Estimation of the Diastereoselectivity Effect by Means of two Approximate Methods (str.1217-1224) engleskipdf 3 MB
Nenad Raos, Vladimir Simeon
Izvorni znanstveni članak
 
Penetration in the CNDO Theory (str.1225-1229) engleskipdf 2 MB
Alexander Koukoulas, Michael A . Whitehead
Izvorni znanstveni članak
 
Foreword engleskipdf 392 KB
Zvonimir B. Maksić
Uvodnik
 
Introduction engleskipdf 124 KB
Ostalo  
Impressum engleskipdf 1 MB
Ostalo  
Ad engleskipdf 4 MB
Ostalo  
Conclusion engleskipdf 190 KB
Ostalo  
Cover Page engleskipdf 407 KB
Ostalo  
Author Index engleskipdf 180 KB
Kazalo  
Posjeta: 3.236 *