Benha University
Staff Search:
Go
Login
You are in:
Home
/
Publications
Prof.
Ahmed
Shalaby
::
Publications:
Research Fields
Body Energies
Mathematical Chemistry
Excited State Properties
initio Calculations
Molecular Graphs
Edge Eraure Technique
Spectral Moments
Number of publications is 17
Title
1-
DFT study of adsorbing SO2, NO2, and NH3 gases based on pristine and carbon-doped Al24N24 nanocages
Abstract
'
|
Full paper
2-
Metallophthalocyanine and Metallophthalocyanine–fullerene complexes as potential dye sensitizers for solar cells DFT and TD-DFT calculations
Abstract
'
|
Full paper
3-
Ground and Excited State Properties of Many Body Energies in Linn+F- ions.Molec. Phys. 75, 6 (1992) 1365U.K
4-
Ground and Excited State Properties of Many Body Energies in Linn+F- ions.Molec. Phys. 75, 6 (1992) 1365U.K
5-
Ab initio Calculations of Many Body Energy Expansion in Linn+F- Clusters.I.J.Quantum Chemistry 41 (1992) 281U.S.A
6-
Normal Coordinate Analysis of IOF5, ReOF5 and OsOF5Gazzetta Chimica Italiana 121 (1991) 555Italy
7-
Nodal Configurations and Many Body Energies in Li33+,F33+,F22- ions at Crystal and Cluster Geometries.Chemical Physics, 156 (1991) 359U.S.A
8-
Random Walks: Computations and Applications to ChemistryJ.Chem. Inf. Comput. Sci. 31(1991) 483U.S.A
9-
Random Walks: Computations and Applications to ChemistryJ.Chem. Inf. Comput. Sci. 31(1991) 483U.S.A
10-
Structural Investigation of Isatin – Arylhydrazone Derivatives byUV, IR, H-NMR Spectra and PPP CI CalculationsSpectro Chimica Acta 44A 8 (1987) 849U.S.A
11-
Hessenberg Matrix In Molecular Graph TheoryChimica Scripta 25 (1985) 252Sweden
12-
Edge Eraure Technique of Computing the Characteristic Polynomialof Molecular GraphsCommunications MATCH in Mathematical Chemistry 18(1985)3W. Germany
13-
On the Ordering of Kekule Structures : Spectral Moments of Factors Graphsof Benzenoid HydrocarbonsCommunications MATCH in Mathematical Chemistry 17(1985) 11W. Germany
14-
Topological Properties of Beneziod Systems : On Hosoya Topological Index.Z. Naturforsch 39A(1984)797W. Germany
15-
Rates and mechanisms of the intermolecular cation-exchangereactions of sodium tetraphenyl boron with sodium- nitrobenzeneand with sodium- p-nitrobenzonitrile}Organic Magnetic Resonance 22 7(1984) 456 U.S.A
16-
On the Ordering of Kekule Structures : Spectral Moments as Measuresof Conjugation in Cyclobutadiene DerivativesCommunications MATCH in Mathematical Chemistry 14(1983)191}W. Germany
17-
ESR studies of ion association: effects on ion pairing onhyperfine splittings in p-substituted Nitrobenzene anionsJCS.Faraday II 76 (1980) 822. U.K.
