Prof. Hilal S. Wahab
Department of Chemistry, College of Science
Al-Nahrain University, Baghdad, Iraq
Professor
Email: hswahab@gmail.com
Research fields:
Photocatalysis
Computational Chemistry
Environmental Pollution Chemistry
Qualifications:
2006 Ph.D., Computational Chemistry, Al-Mustansiria University (Hanover University, Germany), Iraq
1979 M.Sc., Analytical Chemistry, Carleton University(Ottawa), Canada
1975 B.Sc., Chemistry, Mosul University, Iraq
Publications (selected)
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Hilal S. Wahab “Quantum chemical modeling study of adsorption of benzoic acid on anatase TiO2 nanoparticles” J. Molecular Modeling 18 (2012) 2709-2716.
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Hilal S. Wahab “Molecular modeling of the adsorption and initial photocatalytic oxidation step for para-nitrophenol on nano-sized Ti surface . Surface Science 606 (2012) 624-633.
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Hilal S. Wahab, Salam H. Ali, Adi M.Abdul Hussein “Adsorption of H2O, CO2, O2, Ti and Cu on graphene: A molecular modeling approach” Int. J of Basic & Applied Sciences 12 (2012) 234-240.
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Athinoula Petrou, Andreas D. Koutselos, Hilal S. Wahab, William Clegg, Ross W. Harrington and Richard A. Henderson “Kinetic and Theoretical Studies on the Protonation of [Ni(2-SC6H4N){PhP(CH2CH2PPh2)2}]+: Nitrogen versus Sulfur as the Protonation Site” Inorg. Chem. 50 (2011) 847–857.
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Hilal S.Wahab and Andreas D. Koutselos “Comparative study of the adsorption of aromatic pollutants onto TiO2 (100) surface via molecular simulation” Aust. J. Chem. 64 (2011) 1611-1616.
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Hilal S.Wahab, Thomas Bredow, Salah M. Aliwi “A Computational study on the adsorption and ring cleavage of para-chlorophenol on anatase Ti O2 surface” Surface Science 604 (2009) 664.
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Hilal S.Wahab and Andreas D. Koutselos "A Computational study on the adsorption and OH initiated photochemical and photocatalytic primary oxidation of aniline" Chemical Physics 358 (2009) 171.
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Hilal S.Wahab and Andreas D. Koutselos “Computational modeling of the adsorption and OH initiated photochemical and photocatalytic primary oxidation of nitrobenzene” J. Molecular Modeling 15 (2009) 1237.
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Hilal S.Wahab, Thomas Bredow, Salah M. Aliwi "Computational modeling of the adsorption and photodegradation of 4-chlorophenol on anatase TiO2 particles"J. Molecular Structure:THEOCHEM 863 (2008) 84.
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Hilal S.Wahab, Thomas Bredow, Salah M. Aliwi “Computational investigation of water and oxygen adsorption on the anatase TiO2 (100) surface” J. Molecular Structure:THEOCHEM 868 (2008) 101.
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Hilal S.Wahab, Thomas Bredow, Salah M. Aliwi “MSINDO quantum chemical modeling study of water molecule adsorption at nano-sized anatase TiO2 surfaces” Chemical Physics 354 (2008) 50.
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Hilal S.Wahab, Thomas Bredow, Salah M. Aliwi “Computational investigation of the adsorption and photocleavage of chlorobenzene on anatase TiO2 surfaces"Chemical Physics 353 (2008) 93.
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H.S.Wahab and C.L.Chakrabarti "Studies on the sensetivity of yttrium by electrothermal atomization from metallic and metal-carbide surfaces of a heated graphite atomizer in atomic absorption spectrometry", Spectrochimica Acta 36B(no 5),463(1981).
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H.S.Wahab and C.L.Chakrabarti " Mechanism of yttrium atom formation in electrothermal atomization from metallic and metal-carbide surfaces of a heated graphite atomizer in atomic absorption spectrometry" , Spectrochimica Acta 36B(no 5),475(1981).
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Last updated: July, 2015