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Rifaat Hilal
Rifaat Hilal
Professor of Theoretical Chemistry , Cairo University, Egypt.
Verified email at kau.edu.sa - Homepage
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Cited by
Year
Interaction of polar and nonpolar organic pollutants with soil organic matter: Sorption experiments and molecular dynamics simulation
AA Ahmed, S Thiele-Bruhn, SG Aziz, RH Hilal, SA Elroby, AO Al-Youbi, ...
Science of the total environment 508, 276-287, 2015
822015
Nonadiabatic dynamics of cycloparaphenylenes with TD-DFTB surface hopping
L Stojanovic, SG Aziz, RH Hilal, F Plasser, TA Niehaus, M Barbatti
Journal of Chemical Theory and Computation 13 (12), 5846-5860, 2017
642017
The regioselectivity in the formation of pyrazolines and pyrazoles from nitrile imines
HM Hassaneen, RH Hilal, NM Elwan, A Harhash, AS Shawali
Journal of heterocyclic chemistry 21 (4), 1013-1016, 1984
601984
Vibrational analysis of the spectra of furan and thiophene
AA El-Azhary, RH Hilal
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 53 (9 …, 1997
581997
Effect of gamma irradiation on ethylene propylene diene terpolymer rubber composites
MM Abou Zeid, ST Rabie, AA Nada, AM Khalil, RH Hilal
Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2008
542008
Unraveling the electronic structure of photocatalytic manganese complexes by L-edge X-ray spectroscopy
SI Bokarev, M Khan, MK Abdel-Latif, J Xiao, R Hilal, SG Aziz, EF Aziz, ...
The Journal of Physical Chemistry C 119 (33), 19192-19200, 2015
492015
Experimental and theoretical assignment of the vibrational spectra of triazoles and benzotriazoles. Identification of IR marker bands and electric response properties
SG Aziz, SA Elroby, A Alyoubi, OI Osman, R Hilal
Journal of molecular modeling 20, 1-15, 2014
352014
BSSE effects on the static dipole polarizability and first dipole hyperpolarizability of diclofenac sodium
IM Kenawi, AH Kamel, RH Hilal
Journal of Molecular Structure: THEOCHEM 851 (1-3), 46-53, 2008
352008
The thermodynamic and kinetic properties of 2-hydroxypyridine/2-pyridone tautomerization: a theoretical and computational revisit
SA Hejazi, OI Osman, AO Alyoubi, SG Aziz, RH Hilal
International Journal of Molecular Sciences 17 (11), 1893, 2016
322016
Mixed bivalent transition metal complexes of 1, 10-phenanthroline and 2-aminomethylthiophenyl-4-bromosalicylaldehyde Schiff base: Spectroscopic, molecular modeling and …
MS Aljahdali, AA El-Sherif, RH Hilal, AT Abdel-Karim
European Journal of Chemistry 4 (4), 370-378, 2013
312013
Time dependent–density functional theory characterization of organic dyes for dye-sensitized solar cells
R Hilal, SG Aziz, OI Osman, JL Bredas
Molecular Simulation 43 (18), 1523-1531, 2017
282017
A theoretical and experimental investigation of the electronic spectra and tautomerization of nucleobases
AO Alyoubi, RH Hilal
Biophysical chemistry 55 (3), 231-237, 1995
281995
How soil organic matter composition controls hexachlorobenzene–soil-interactions: adsorption isotherms and quantum chemical modeling
AA Ahmed, O Kühn, SG Aziz, RH Hilal, P Leinweber
Science of the Total Environment 476, 98-106, 2014
262014
A comparative quantum chemical study of methyl acetate and S-methyl thioacetate Toward an understanding of the biochemical reactivity of esters of coenzyme A
R Hilal, AM El-Aaser
Biophysical chemistry 22 (3), 145-150, 1985
241985
Quantum topology of the charge density of chemical bonds. QTAIM analysis of the C-Br and O-Br bonds
R Hilal, SG Aziz, AO Alyoubi, S Elroby
Procedia Computer Science 51, 1872-1877, 2015
232015
Unconventional hydrogen bonding to organic ions in the gas phase: Stepwise association of hydrogen cyanide with the pyridine and pyrimidine radical cations and protonated pyridine
AM Hamid, MS El-Shall, R Hilal, S Elroby, SG Aziz
The Journal of Chemical Physics 141 (5), 2014
232014
Hydration of the pyrimidine radical cation and stepwise solvation of protonated pyrimidine with water, methanol, and acetonitrile
AM Hamid, P Sharma, M Samy El-Shall, R Hilal, S Elroby, SG Aziz, ...
The Journal of Chemical Physics 139 (8), 2013
222013
Electronic structure of orotic acid I. Geometry, conformational preference and tautomerism
R Hilal, ZM Zaky, SAK Elroby
Journal of Molecular Structure: THEOCHEM 685 (1-3), 35-42, 2004
222004
An ab initio study of the structures and energetics of the planar ground and 90°‐twisted excited states of substituted ethylenes
S El‐Taher, RH Hilal, TA Albright
International Journal of Quantum Chemistry 82 (5), 242-254, 2001
222001
Effect of gamma and UV radiation on properties of EPDM/GTR/HDPE blends
MMA Zeid, ST Rabie, AA Nada, AM Khalil, RH Hilal
Polymer-Plastics Technology and Engineering 47 (6), 567-575, 2008
212008
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Articles 1–20