List of refereed publications in 1995-93 for Gabor I. Csonka
- (38) Csonka, G. I., Anh, N. , Ángyán, J. G., Csizmadia, I. G., Investigation of
intramolecular hydrogen bonding in 1,2-ethanediol using density functional methods, Chem.
Phys. Lett., 245, 129 (1995). reprint,
cited: 14(9)
- (37) Csonka, G. I. and Csizmadia, I. G., Density functional conformational
analysis of 1,2-ethanediol, Chem. Phys. Lett., 243, 419 (1995). reprint,
cited:
27(22)
- (36) Csonka, G. I., Anh, N., and Réffy, J., The performance of Generalized
Gradient Approximation DFT methods with gaussian basis sets: Sulfur and
Chlorine-containing molecules, Porceedings
of First Electronic Computational Chemistry Conference (1995).
- (35) Csonka, G. I. and Anh, N., The ability of the MP2 and MP3 methods to model
the QCISD(T) basis set extension effects for the hydrogen atoms in molecules, Porceedings of First Electronic
Computational Chemistry Conference (1995).
- (34) Csonka, G. I. and Sztraka L., Density functional and post Hartree-Fock equilibrium
geometries, potential energy surface and vibrational frequencies for methylamine, Chem.
Phys. Lett., 233, 611 (1995). reprint,
cited: 12(8)
- (33) Csonka, G. I. and Réffy, J., The failure of the MO-based theoretical
explanations for bending of disiloxane, J. Mol. Struct. (Theochem), 332, 187
(1995). cited: 3(3)
- (32) Nyulászi, L., Szieberth, D., Csonka, G. I., Heinicke J., and Veszprémi,
T., The Photoelectron Spectrum and Conformation of Phenyl-phosphine and Phenyl-arsine,
Struct. Chem., 6, 1 (1995). cited: 6(3)
- (31) Csonka, G. I., Loos, M., Kucsman, A, and Csizmadia, I. G., Ab Initio
geometry optimization of the Cl-S(H)OH-Cl uneven sulfurane with the inclusion of electron
correlation, J. Mol. Struct. (Theochem), 315, 29 (1994). 1(1)
- (30) Náray-Szabó, G., Tóth, G., Ferenczy, G. and Csonka, G., The NDDO fragment
Selfconsistent field method for the treatment of very large covalent systems, Int. J. of
Quantum Chem. Quantum Biol. Symp. 21, 227 (1994).
- (29) Csonka, G. I., Loos, M., Kucsman, A, and Csizmadia, I. G., Ab Initio study
of the energy hypersurface of uneven sulfuranes. Dissociation of HCl from Cl-SH(OH)-Cl,
Chem. Phys. Lett., 230, 203 (1994).
- (28) Csonka, G. I. and Réffy, J., Density-functional study of the equilibrium
geometry and Si-O-Si potential energy curve of disiloxane, Chem. Phys. Lett., 229,
191 (1994). cited: 12(9)
- (27) Csonka, G. I., Erdosy, M. and Réffy, J., Structure of Disiloxane:
Semiempirical and post-Hartree-Fock study, J. Comp. Chem., 15, 925 (1994). cited: 14(11)
- (26) Nagy, J., Nyitrai, J. and Csonka G., Neue Beiträge zum mechanismus der
photoringverengung von 1,2,4-triazinen, J. Inf. Rec. Mats. 21, 467 (1994).
- (25) Csonka, G. I. and Hencsei, P., Ab initio molecular orbital study of
1-fluorosilatrane, J. Comp. Chem., 15, 385 (1994).
cited:
17(14)
- (24) Csonka, G. I.; Nemes, L. and Ogilvie, J. F., Wavenumbers and intensities of
the fundamental vibrational modes of HNSi and DNSi from quantum-chemical computations, J.
Mol. Struct., 297, 243 (1993).
- (23) Csonka, G. I., Analysis of the core-repulsion functions used in the AM1 and
PM3 semiempirical calculations: conformational analysis of ring systems, J. Comp. Chem., 14,
895 (1993). cited: 29 (26)
- (22) Csonka, G. I. and Hencsei, P., MNDO, AM1 and PM3 semiempirical molecular
orbital study of silatranes III., 1-chlorosilatrane, J. Organomet. Chem., 454. 15
(1993). cited: 13(8)
- (21) Csonka, G. I. and Hencsei, P., AM1 and PM3 semiempirical molecular orbital
study of silatranes. Part 2. 1-Methylsilatrane, J. Mol. Struct. (Theochem), 283.
251 (1993). cited:13(7)
- (20) Csonka, G. I. and Hencsei, P., MNDO, AM1 and PM3 semiempirical molecular
orbital study of 1-fluorosilatrane, J. Organomet. Chem., 446, 99 (1993). cited: 16(9)