Gábor Pongor
Eötvös Loránd University(HU)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Molecular spectroscopy and chirality, Nonlinear Optical Materials Research, Crystallization and Solubility Studies
Most-Cited Works
- → Combination of theoretical ab initio and experimental information to obtain reliable harmonic force constants. Scaled quantum mechanical (QM) force fields for glyoxal, acrolein, butadiene, formaldehyde, and ethylene(1983)1,540 cited
- → Theoretical prediction of vibrational spectra. 1. The in-plane force field and vibrational spectra of pyridine(1984)135 cited
- → Vibrational analysis of 2-nitrophenol. A joint FT-IR, FT-Raman and scaled quantum mechanical study(1998)86 cited
- → Harmonic force field: An approximate relationship between the exact nonrelativistic and the Hartree–Fock limit values of the force constants(1991)74 cited
- → Extension of the density functional derived scaled quantum mechanical force field procedure(2002)60 cited
- → Theoretical prediction of vibrational spectra. The a priori scaled quantum mechanical (SQM) force field and vibrational spectra of pyrimidine(1992)57 cited
- → Theoretical prediction of vibrational spectra: The out-of-plane force field and vibrational spectra of pyridine(1985)38 cited
- → Scaled quantum mechanical (SQM) force field and vibrational assignment for styrene(1994)30 cited
- → On the application of Saunders' level shifting technique to CNDO/2 calculations(1974)15 cited
- → Experimental and Theoretical Analysis of the Vibrational Spectra and Theoretical Study of the Structures of 3,6-Dichloropyridazine and 3,4,5-Trichloropyridazine(2000)14 cited