Journal Publications Presentations Conferences
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Publications

  • H. M. Badawi, W. Forner, and A. Al-Saadi, “An investigation of structural stability and analysis of vibrational spectra of formyl ketene based on ab initio calculations”. Journal of Molecular Structure (Theochem), 505 (2000) 19.
  • H. M. Badawi, W. Forner, and A. Al-Saadi, “Structural stability and derived potential energy distributions of fluoro- and chloromethyl ketene”. Asian J. Spect., 4 (2000) 67.
  • H. M. Badawi, W. Forner, and A. Al-Saadi, “C-C and C-N rotational barriers in vinyl ketene and vinyl isocyanate”. Journal of Molecular Structure (Theochem), 535 (2001) 183.
  • H. M. Badawi, W. Forner, and A. Al-Saadi, “Density functional calculations of vibrational wavenumbers and derived potential energy distributions for fluoro- and chlorocarbonyl ketene”. Journal of Molecular Structure, 561 (2001) 103.
  • W. Forner, H. M. Badawi, A. Al-Saadi, and S. A. Ali, “Vibrational assignments and derived potential energy distributions for tri- and difluoromethyl ketene by density functional calculations ”. Journal of Molecular Modeling, 7 (2001) 343.
  • H. M. Badawi, A. Al-Saadi, and W. Forner, “Substituents effect on structural stability of formyl ketene and analysis of vibrational spectra of formyl haloketenes and formyl methylketene”. Spectrochimica Acta Part A, 58 (2002) 33.
  • Abdulaziz A. Al-Saadi and Hassan M. Badawi, “Theoretical potential functions of halocarbonyl ketenes and halocarbonyl isocyanates and vibrational spectra of the bromides”. Journal of Molecular Structure (Theochem), 582 (2002) 11.
  • Hassan M. Badawi and Abdulaziz A. Al-Saadi, “Theoretical vibrational spectra of isocyanatoketene O=C=CH-N=C=O”, Journal of Molecular Structure (Theochem), 676 (2004) 35.
  • H. M. Badawi, W. Forner, and Abdulaziz A. Al-Saadi, “DFT-B3LYP versus MP2, MP3 and MP4 calculations of the structural stability of azidoketene O=C=CH-NNN”, Journal of Molecular Structure (Theochem), 712 (2004) 131.
  • Hassan M. Badawi and Abdulaziz A. Al-Saadi, “Conformational stability and normal coordinate analyses of imidoylketene O=C=CH-CH=NH”, Journal of Molecular Structure (Theochem), 784 (2006) 259.
  • Abdulaziz A. Al-Saadi, Martin Wagner and Jaan Laane, “Spectroscopic and computational studies of the intramolecular hydrogen bonding of 2-indanol”, Journal of Physical Chemistry A, 110 (2006) 12292.
  • Abdulaziz A. Al-Saadi and Jaan Laane, “Vibrational spectra, ab initio calculations, and ring-puckering potential energy function for γ-crotonolactone”, Journal of Physical Chemistry A, 111 (2007) 3302.
  • Abdulaziz A. Al-Saadi, N. Meinander and J. Laane, “The ring-puckering potential energy function and theoretical calculations for silacyclopent-2-ene-d0 and 1,1-d2 and the difluoro and dichloro derivatives”, Journal of Molecular Spectroscopy, 242 (2007) 17.
  • Abdulaziz A. Al-Saadi and Jaan Laane, “Ab initio and DFT calculations for the structure and vibrational spectra of cyclopentene and its isotopomers”, Journal of Molecular Structure., 830 (2007) 46.
  • Abdulaziz A. Al-Saadi and Jaan Laane, “Raman and infrared spectra, ab initio and DFT calculations, and vibrational assignments for 2,3-cyclopentenopyridine”, Spectrochimica Acta Part A, 71 (2008) 326.
  • Abdulaziz A. Al-Saadi and Jaan Laane, “Structure, vibrational spectra, and DFT and ab initio calculations of silacyclobutanes”, Organometallics, 27 (2008) 3454.
  • H. M. Badawi, A. A. Al-Saadi, M. A. A. Al-Khaldi, S. A. Al-Abad, Z. H. A. Al- Sunaidi, “Potential energy scans and vibrational assignments of cyclopropanecarboxylic acid and cyclopropanecarboxamide”, Spectrochimica Acta Part A, 71 (2008) 1540.
  • H. M. Badawi, W. Forner, and A. Al-Saadi, “Structural stability, NH2 inversion and vibrational assignments of 2,4,6-trichloroaniline and 2,3,5,6-tetrachloroaniline”, Journal of Molecular Structure, 938 (2009) 41.
  • H. M. Badawi, A. A. Al-Saadi, S. A. Ali, “Structural stability and analysis of vibrational spectra of 1,2,4,5-tetroxane and 3,6-diphenyl-1,2,4,5-tetroxane”, Journal of Molecular Structure, 969 (2010) 197.
  • Abdulaziz A. Al-Saadi, Esther J. Ocola, Jaan Laane, “Intramolecular π-type hydrogen bonding and conformations of 3-cyclopenten-1-ol. 1. Theoretical calculations”, Journal of Physical Chemistry A, 114 (2010) 7453.
  • E. J. Ocola, A. A. Al-Saadi, C. Mlynek, H. Hopf, J. Laane, “Intramolecular π-type hydrogen bonding and conformations of 3-cyclopenten-1-ol. 2. Infrared and Raman spectral studies at high temperatures”, Journal of Physical Chemistry A, 114 (2010) 7457.
  • H. M. Badawi, A. A. Al-Saadi, “Conformational profile and vibrational assignments of hippuric and 4-aminohippuric acids”, Journal of Molecular Structure, 990 (2011) 176.
  • Zulhusni B. Saad, Chong Shu Xian, Wong Zhi Xiang, Hassan Hadi Abdallah, Abdulaziz A. Al-Saadi, “Structural properties and vibrational spectra of 2-formyloxazole and its 2-thioformyl and 2-selenoformyl derivatives”, Journal of Molecular Structure, 1006 (2011) 655–664.
  • Mohammed A. Gondal, Xiaofeng Chang, Abdulaziz A. Al-Saadi, Zain H. Yamani, Qin Zhou, Guangbin Ji, “BiOCl-assisted photodegradation of Rhodamine B under white light and monochromatic green pulsed laser irradiation”, Journal of Environmental Science and Health, Part A: Toxic/Hazardous Substances & Environmental Engineering, 47 (2012) 1192.
  • Abdulaziz A. Al-Saadi, “Conformational analysis and vibrational assignments of benzohydroxamic acid and benzohydrazide”, Journal of Molecular Structure, 1023 (2012) 115-122.
  • Xiaofeng Chang, M. A. Gondal, A. A. Al-Saadi, M. A. Ali, Hefei Shen, Qin Zhou, Jun Zhang, Mengping Du, Yousong Liu, Guangbin Ji, “Photodegradation of Rhodamine B over unexcited semiconductor compounds of BiOCl and BiOBr”, Journal of Colloid & Interface Science, 377 (2012) 291-298.
  • Abdulaziz A. Al-Saadi, “Further insights on the molecular structure, vibrational spectra and ring-puckering potentials of silacyclopent-3-ene and its 1,1-dihalo derivatives: ab initio and DFT study”, Vibrational Spectroscopy, 62 (2012) 188-199.
  • Tawfik A. Saleh, Vinod Kumar Gupta, Abdulaziz A. Al-Saadi, “Adsorption of lead ions from aqueous solution using porous carbon derived from rubber tires: experimental and computational study”, Journal of Colloid & Interface Science, 396 (2013) 264-269.
  • Abdulaziz A. Al-Saadi, Vinod Kumar Gupta, Tawfik A. Saleh, “Experimental and theoretical study of the characteristics of activated carbons produced from waste rubber tire and adsorption of cadmium”, Journal of Molecular Liquids, 188 (2013) 136-142.
  • H. M. Badawi, A. A. Al-Saadi, S. A. Ali, “The vibrational assignments of the infrared and Raman spectra of the symmetrically substituted 2,3-diphenylquinoxaline and its N,N’-dioxide: experimental and computational study”, Journal of Molecular Structure, 1058 (2014) 284–290.
  • Shan Shi, M.A. Gondal, A.A. Al-Saadi, Radek Fajgar, Jaroslav Kupcik, Xiaofeng Chang, Kai Shen, Qingyu Xu, Z.S. Seddigi, “Facile preparation of g-C3N4 modified BiOCl hybrid photocatalyst and vital role of frontier orbital energy levels of model compounds in photoactivity enhancement”, Journal of Colloid & Interface Science, 416 (2014) 212–219.
  • Tawfik A. Saleh, Abdulaziz A. Al-Saadi, V. K. Gupta, “Carbonaceous adsorbent prepared from waste tires: Experimental and computational adsorption of organic dye methyl orange”, Journal of Molecular Liquids, 191 (2014) 85–91.
  • E. A. Jaseer, Miguel A. Casado, Abdulaziz A. Al-Saadi, Luis A. Oro, “Intermolecular hydroamination versus stereoregular polymerization of phenylacetylene by rhodium catalysts based on N-O bidentate ligands”, Inorganic Chemistry Communications, 40 (2014) 78–81.
  • S. Sakthivel, T. Alagesan, A. A. Al-Saadi, S. Renuga, S. Muthu, “Vibrational spectra of 3,5-diamino-6-chloro-N-(diaminomethylene) pyrazine-2-carboxamide: Combined experimental theoretical study”, Spectrochimica Acta Part A, 127 (2014) 157–167.
  • Y. S. Mary, K. Raju, C. Y. Panicker, A. A. Al-Saadi, T. Thiemann, C. Van Alsenoy, “Molecular conformational analysis, vibrational spectra, NBO analysis and first hyperpolarizability of (2E)-3-phenylprop-2-enoic anhydride based on density functional theory calculations”, Spectrochimica Acta Part A, 128 (2014) 638–646.
  • Shan Shi, M.A. Gondal, S.G. Rashid, Q. Qi, A. A. Al-Saadi, Z.H. Yamani, Yihe Sui, Qingyu Xu, Kai Shen, “Synthesis of g-C3N4/BiOClxBr1-x hybrid photocatalysts and the photoactivity enhancement driven by visible light”, Colloides and Surface A: Physicochemical and Engineering Aspects, 461 (2014) 202–211.
  • Y. Sheena Mary, K. Rajub, C. Yohannan Panicker, Abdulaziz A. Al-Saadi, Thies Thiemann, “Molecular conformational analysis, vibrational spectra, NBO analysis and first hyperpolarizability of (2E)-3-(3-chlorophenyl)prop-2-enoic anhydride based on density functional theory calculations”, Spectrochimica Acta Part A, 131 (2014) 471–483.
  • Y. Sheena Mary, C. Yohannan Panicker, T. S. Yamuna, M.S. Siddegowda, H. S. Yathirajan, Abdulaziz A. Al-Saadi, Christian Van Alsenoy, “ Theoretical investigations on the molecular structure, vibrational spectral, HOMO–LUMO and NBO analysis of 9-[3-(dimethylamino)propyl]-2-trifluoro-methyl-9H-thioxanthen-9-ol”, Spectrochimica Acta Part A, 132 (2014) 491–501.
  • Said S. Al-Jaroudi, M. Monim-ul-Mehboob, Muhammad Altaf, Abdulaziz A. Al-Saadi, Mohammed I. M. Wazeer, Saleh Altuwaijri and Anvarhusein A. Isab, “Synthesis, spectroscopic characterization, electrochemical behavior and computational analysis of mixed diamine ligand gold(III) complexes: antiprolifeartive and in vitro cytotoxic evaluations against human cancer cell lines”, Biometals, 27 (2014) 1115-1136.
  • Ebtehal S. Al-Abdullah, Y. Sheena Mary, C. Yohannan Panicker, Nasser R. El-Brollosy, Ali A. El-Emam, Christian Van Alsenoy, Abdulaziz A. Al-Saadi, “Theoretical investigations on the molecular structure, vibrational spectra, HOMO-LUMO analyses and NBO study of 1-[(cyclopropylmethoxy)methyl]-5-ethyl-6-(4-methylbenzyl)-1,2,3,4-tetrahydropyrimipanidine-2,4-dione”, Spectrochimica Acta Part A, 133 (2014) 639–650.
  • Victor Polo, Abdulaziz A. Al-Saadi, Luis A. Oro, “Theoretical studies on the mechanism of iridium-catalyzed alkene hydrogenation by the cationic complex [IrH2(NCMe)3(PiPr3)]+ ”, Organometallics, 33 (2014) 5156-5163.
  • R. Shahidha, Abdulaziz A. Al-Saadi, S. Muthu, “Vibrational spectroscopic studies, normal co-ordinate analysis, first order hyperpolarizability, HOMO-LUMO of midodrine by using density functional method”, Spectrochimica Acta Part A, 134 (2015) 127–142.
  • Y. Sheena Mary, T. S. Yamuna, C. Yohannan Panicker, H. S. Yathirajan, M. S. Siddegowda, Abdulaziz A. Al-Saadi, Christian Van Alsenoy, Javeed Ahmad War, “Vibrational spectroscopic studies and molecular docking of 10,10-dimethylanthrone”, Spectrochimica Acta Part A, 135 (2015) 652-661.
  • Nadia G. Haress, Fatmah A. M. Alomary, Ali A. El-Emam, Y. Sheena Mary, C. Yohannan Panicker, Abdulaziz A. Al-Saadi, Javeed Ahmad War, Christian Van Alsenoy, “Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO-LUMO analysis and molecular docking study of 2-(Adamantan-1-yl)-5-(4-nitrophenyl)-1,3,4-oxadiazole”, Spectrochimica Acta Part A, 135 (2015) 973–983.
  • Abdullah Al-Sunaidi, Abdulaziz A. Al-Saadi, “First principle calculations of the chemisorption of SOx on doped carbon nanotubes and graphene”, Chemical Physics Letters, 621 (2015) 65–70.
  • Kai Shen, M. A. Gondal , A. A. Al-Saadi, Li Liye, Xiaofeng Chang ,Qingyu Xu, “Visible light-induced photodegradation of rhodamine dyes over BiOCl, and the vital importance of the frontier orbital energy of the dye molecules in the reaction kinetics”, Research on Chemical Intermediates, 41 (2015) 2753-2766.
  • Y. Sheena Mary, C. Yohannan Panicker, C.N. Kavitha, H.S. Yathirajan, M.S. Siddegowda, Sandra M.A. Cruz, Helena I.S. Nogueira, Abdulaziz A. Al-Saadi, Christian Van Alsenoy, Javeed Ahmad War, “Spectroscopic investigation (FT-IR, FT-Raman and SERS), vibrational assignments, HOMO-LUMO analysis and molecular docking study of Opipramol”, Spectrochimica Acta Part A, 137 (2015) 547–559.
  • Saheed A. Popoola, Abdulaziz A. Al-Saadi, “Spectroscopic evaluation of the molecular structures of di-μ-chlorobis(1,5-cyclooctadiene) iridium(I) and rhodium(I) complexes”, Journal of Applied Mathematics and Physics, 3 (2015) 134-138.
  • Yassin A. Jeilani, Huayang Li, Issifu I. Harruna, Khalid R. S. Alhooshani, Abdulaziz A. Al-Saadi, “Collision induced dissociations of non-derivatized and trimethylsilyl- derivatized estradiols: similarities in fragmentation patterns”, Journal of Mass Spectrometry, 50 (2015) 308–315.
  • N.R. Sheela, S Muthu, S. Sampathkrishnan; Abdulaziz A. Al-Saadi, “Normal co-ordinate analysis, molecular structural, non-linear optical, second order perturbation studies of tizanidine by density functional theory”, Spectrochimica Acta Part A, 139 (2015) 189–199.
  • Nourah Z. Alzoman, Y. Sheena Mary, C. Yohannan Panicker, Ibrahim A. Al-Swaidan,
Ali A. El-Emam, Omar A. Al-Deeb, Abdulaziz A. Al-Saadi, Christian Van Alsenoy, Javeed Ahmad War, “Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO–LUMO, NBO, MEP analysis and molecular docking study of 2-[(4-chlorobenzyl)sulfanyl]-4-(2-methylpropyl)-6-(phenylsulfanyl)-pyrimidine-5-carbonitrile, a potential chemotherapeutic agent”, Spectrochimica Acta Part A, 139 (2015) 413–424.
  • Huading Shi, M.A. Gondal, A.A. Al-Saadi, Xiaofeng Chang, “Visible-light-induced photo-degradation enhancement of methyl orange over bismuth oxybromide through a semiconductor mediated process”, Journal of Advanced Oxidation Technologies, 18 (2015) 78–84.
  • J. Sherin Percy Prema Leela , R. Hemamalini , S. Muthu, Abdulaziz A. Al-Saadi, “Spectroscopic investigation (FTIR spectra), NBO, HOMO–LUMO energies, NLO and thermodynamic properties of 8-methyl-N-vanillyl-6-nonenamide by DFT methods”, Spectrochimica Acta Part A, 146 (2015) 177–186.
  • Dana Němečková, Y. Sheena Mary, C. Yohannan Panicker, Hema Tresa Varghese, Christian Van Alsenoy, Markéta Procházková, Pavel Pazdera, Abdulaziz A. Al-Saadi, “1-Alkyl-1-methylpiperazine-1,4-diium salts: Synthetic, acid–base, XRD-analytical, FT-IR, FT-Raman spectral and quantum chemical study”, Journal of Molecular Structure, 1094 (2015) 210–236.
  • Fatmah A. M. Al-Omary, Y. Sheena Mary, C. Yohannan Panicker, Ali A. El-Emam, Ibrahim A. Al-Swaidan, Abdulaziz A. Al-Saadi, C. Van Alsenoy, “Spectroscopic investigations, NBO, HOMO–LUMO, NLO analysis and molecular docking of 5-(adamantan-1-yl)-3-anilinomethyl-2,3-dihydro- 1,3,4-oxadiazole-2-thione, a potential bioactive agent”, Journal of Molecular Structure, 1096 (2015) 1–14.
  • Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “Surface characterization and sorption efficacy of tire-obtained carbon: experimental and semiempirical study of Rhodamine B adsorption”, Surface and Interface Analysis, 47 (2015) 785–792.
  • Y. Sheena Mary, Hema Tresa Varghese, C. Yohannan Panicker, Thies Thiemann, Abdulaziz A. Al-Saadi, Saheed A. Popoola, C. Van Alsenoy, Yosef Al Jasem, “Molecular conformational analysis, vibrational spectra, NBO, NLO, HOMO- LUMO and molecular docking studies of ethyl 3-(E)-(anthracen-9-yl)prop-2-enoate based on density functional theory calculations”, Spectrochimica Acta Part A, 150 (2015) 533–542.
  • Said S. Al-Jaroudi, Muhammad Altaf, Abdulaziz A. Al-Saadi, Abdel-Nasser Kawde, Saleh Altuwaijri, Saeed Ahmad, Anvarhusein A. Isab, “Synthesis, characterization and theoretical calculations
of (1,2-diaminocyclohexane)(1,3-diaminopropane)gold(III) chloride complexes: in vitro cytotoxic evaluations against human cancer cell lines”, Biometals, 28 (2015) 827-844.
  • Y. Sheena Mary, C. Yohannan Panicker, Thies Thiemann, Mariam Al-Azani, Abdulaziz A. Al-Saadi, C. Van Alsenoy, K. Raju, Javeed Ahmad War, SK. Srivastava, “Molecular conformational analysis, vibrational spectra, NBO, NLO analysis and molecular docking study of bis[(E)-Anthranyl-9-acrylic]anhydride based on density functional theory calculations”, Spectrochimica Acta Part A, 151 (2015) 350-359.
  • Saheed A. Popoola, E. A. Jaseer, Abdulaziz A. Al-Saadi, Victor Polo, Miguel A. Casado, Luis A. Oro, “Iridium complexes as catalysts in the hydrogen transfer of isopropanol to acetophenone: effects of additional donor ligands”, Inorganica Chimica Acta, 436 (2015) 146-151.
  • R. Renjith, Y. Sheena Mary, Hema Tresa Varghese, C. Yohannan Panicker, Thies Thiemann, Anas Shereef, Abdulaziz A. Al-Saadi, “Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO-LUMO analysis and molecular docking study of 1-hydroxy-4,5,8-tris(4-methoxyphenyl) anthraquinone”, Journal of Physics and Chemistry of Solids, 87 (2015) 110-121.
  • M. N. Siddiqui, H. H. Redhwi, A. A. Al-Saadi, M. Rajeh, T. A. Saleh, “Kinetic and computational evaluation of activated carbon produced from rubber tires toward the adsorption of nickel in aqueous solutions”, Desalination and Water Treatment, 57 (2016) 17570–17578.
  • Nadia G. Haress, Munusamy Govindarajan, Reem I. AL-Wabli, Maha S. Almutairi, Monirah A. Al-Alshaikh, Abdulaziz A. Al-Saadi, Mohamed I. Attia, “Spectroscopic (FT-IR, FT-Raman, UV, 1H and 13C NMR) profiling and theoretical calculations of (2E)-2-[3-(1H-imidazol-1-yl)-1- phenylpropylidene]hydrazinecarboxamide: An anticonvulsant agent”, Journal of Molecular Structure, 1118 (2016) 219–232.
  • Saheed A. Popoola, Abdulaziz A. Al-Saadi, “Spectroscopic and theoretical evaluation of the metal-olefin interaction in di-μ-chlorobis(1,5-cyclooctadiene) complexes of Ir and Rh”, Vibrational Spectroscopy, 86 (2016) 109–123.
  • Kabiru Haruna, Tawfik A. Saleh, Jameel Al Thagfi, Abdulaziz A. Al-Saadi, “Structural properties, vibrational spectra and surface-enhanced Raman scattering of 2,4,6-trichloro- and tribromoanilines: A comparative study”, Journal of Molecular Structure, 1121 (2016) 7-15.
  • K.S. Resmi, Kabiru Haruna, Y. Sheena Mary, C. Yohannan Panicker, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, Christian Van Alsenoy, “Conformational, NBO, NLO, HOMO-LUMO, NMR, electronic spectral study and molecular docking study of N,N-Dimethyl-3-(10H- phenothiazin-10-yl)-1-propanamine”, Journal of Molecular Structure, 1122 (2016) 268-279.
  • Kabiru Haruna, Tawfik A. Saleh, Mohammad Kamal Hossain, Abdulaziz A. Al-Saadi, “Hydroxylamine reduced silver colloid for naphthalene and phenanthrene detection using surface-enhanced Raman spectroscopy”, Chemical Engineering Journal, 304 (2016) 141-148.
  • Kabiru Haruna, Asem A. Alenaizan, Abdulaziz A. Al-Saadi, “Density functional theory study of the substituent effect on the structure, conformation and vibrational spectra in halosubstituted anilines”, RSC Advances, 6 (2016) 67794 – 67804.
  •  Mutasem M. Al-Shalalfeh, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “Silver colloid and film substrates in surface-enhanced Raman scattering for 2-thiouracil detection”, RSC Advances, 6 (2016) 75282-75292.
  • Tawfik A. Saleh, Mutasem M. Al-Shalalfeh, Abdulaziz A. Al-Saadi, “Graphene dendrimer-stabilized silver nanoparticles for detection of methimazole using surface-enhanced Raman scattering with computational assignment”, Scientific Reports, 6 (2016) 32185.
  • Amaia Iturmendi, Pablo J. Sanz Miguel, Saheed A. Popoola, Abdulaziz A. Al-Saadi, Manuel Iglesias and Luis A. Oro, “Dimethylphosphinate bridged binuclear Rh(I) catalysts for the alkoxycarbonylation of aromatic C–H bonds”, Dalton Transactions, 45 (2016) 16955-16965.
  • Ali Osman S. Altoum, Ali Alhoshani, Khalid Alhosaini, Muhammad Altaf, Saeed Ahmad, Saheed A. Popoola, Abdulaziz A. Al-Saadi, Adam A. Sulaiman & Anvarhusein A. Isab, “Synthesis, characterization and in vitro cytotoxicity of platinum(II) complexes of selenones [Pt(selenone)2Cl2]”, Journal of Coordination Chemistry, 70 (2017) 1020-1031.
  • Mohammad N. Siddiqui, Muhammad Mansha, Umar Mehmood, Nisar Ullah, Abdulrahman F. Al-Betar, Abdulaziz A. Al-Saadi, “Synthesis and characterization of functionalized polythiophene for polymer-sensitized solar cell”, Dyes and Pigments, 141 (2017) 406-412.
  • Mutasem M. Al-Shalalfeh, Abdulmujeeb T. Onawole, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “Spherical silver nanoparticles as substrates in surface-enhanced Raman spectroscopy for enhanced characterization of ketoconazole”, Materials Science and Engineering C, 76 (2017) 356–364.
  • T. A. Saleh, M. M. Al-Shalalfeh, A. A. Al-Saadi, “Silver nanoparticles for detection of methimazole by surface-enhanced Raman spectroscopy”, Materials Research Bulletin, 91 (2017) 173-178.
  • T. A. Saleh, M. M. Al-Shalalfeh, A. T. Onawole, Abdulaziz A. Al-Saadi, "Ultra-trace detection of methimazole by surface-enhanced Raman spectroscopy using gold substrate", Vibrational Spectroscopy, 90 (2017) 96-103.
  • A.T. Onawole , A.F. Al-Ahmadi, Y.S. Mary, C.Y. Panicker, N. Ullah, S. Armaković, S.J. Armaković, C. Van Alsenoy, A. A. Al-Saadi, “Conformational, vibrational and DFT studies of a newly synthesized arylpiperazine-based drug and evaluation of its reactivity towards the human GABA receptor”, Journal of Molecular Structure, 1147 (2017) 266-280.
  • Adam A.A. Seliman, Muhammad Altaf, Abdulmujeeb T. Onawole, Saeed Ahmad, Mohammed Yagoub Ahmed, Abdulaziz A. Al-Saadi, Saleh Altuwaijri, Gaurav Bhatia, Jatinder Singh, Anvarhusein A. Isab “Synthesis, X-ray structures and anticancer activity of gold(I)-carbene complexes with selenones as co-ligands and their molecular docking studies with thioredoxin reductase”, Journal of Organometallic Chemistry, 848 (2017) 175-183.
  • T. A. Saleh, M. M. Al-Shalalfeh, A. A. Al-Saadi, “Silver loaded graphene as a substrate for sensing 2-thiouracil using surface-enhanced Raman scattering”, Sensors and Actuators B: Chemical, 254 (2018) 1110-1117.
  • Muhammad Usman Khan, Muhammad Khalid, Muhammad Ibrahim, Ataualpa A.C. Braga, Muhammad Safdar, Abdulaziz A. Al-Saadi, Muhammad Ramzan Saeed Ashraf Janjua, “First theoretical framework of triphenylamine-dicyanovinylene based nonlinear optical dyes: structural modification of π-linkers”, The Journal of Physical Chemistry C, 122 (2018) 4009-4018.
  • Adam A.A. Seliman, Muhammad Altaf, Abdulmujeeb T. Onawole, Abdulaziz Al-Saadi, Saeed Ahmad, Ali Alhoshani, Gaurav Bhatia, Anvarhusein A Isab, “Synthesis, structure and cytotoxicity evaluation of carbene-based gold (I) complexes of selenones”, Inorganica Chimica Acta, 476 (2018) 46–53.
  • Abdulmujeeb T. Onawole, Mahmoud A. Ghassan, Nisar Ullah, Abdulaziz A. Al-Saadi, “Structural, spectroscopic and docking properties of resorcinol, its –OD isotopomer and dianion derivative: a comparative study”, Structural Chemistry, 29 (2018) 403–414.
  • Abdulmujeeb T. Onawole, Saheed A. Popoola, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “Silver-loaded graphene as an effective SERS substrate for clotrimazole detection: DFT and spectroscopic studies”, Spectrochimica Acta Part A, 201 (2018) 354-361.
  • Ismail Abdulazeez, Chanbasha Basheer, Abdulaziz A. Al-Saadi, “Selective colorimetric sensing of nickel (II) ions using 2-hydroxy-5-nitrobenzaldehyde-4-hydroxybenzoylhydrazone ligand: Spectroscopic and DFT insights”, Journal of Molecular Liquids, 264 (2018) 58-65.
  • Saheed A. Popoola, Nisar Ullah, Abdulaziz A. Al-Saadi, “Spectroscopic and DFT assessment of bridging ligand effect on the structural and electronic properties of dinuclear iridium- and rhodium-based complexes”, Inorganica Chimica Acta, 482 (2019) 299-306.
  • P. Krishna Murthy, V. Suneetha, Smitha. M, Y. Sheena Mary, Stevan Armaković, Sanja J. Armaković, R. Sreenivasa Rao, P.A. Suchetan, Abdulaziz A. Al-Saadi, Rani Pavithran, “Synthesis, conformational, characterisation and reactivity study of 1,7-bis(4-bromophenyl)heptane-1,7-dione”, Journal of Molecular Structure, 1175 (2019) 269-279.
  • Mohammed Yagoub Jomaaa, SaeedAhmad, Adam A.A.Selimanc, Saheed A. Popoolad, Abdul Rajjak Shaikh, Abdulaziz A. Al-Saadi, Gaurav Bhatia, Jatinder Singh, Anvarhusein A. Isab,  “Synthesis, spectroscopic characterization and in vitro cytotoxic as well as docking studies of cis-diammine platinum (II) complexes of thiones”, Inorganica Chimica Acta, 484 (2019) 347-351.
  • M. Kamran, M. Haroon, Saheed A. Popoola, A. R. Almohammedi, Abdulaziz A. Al-Saadi, Tawfik A. Saleh, “Characterization of valeric acid using substrate of silver nanoparticles with SERS”, Journal of Molecular Liquids, 273 (2019) 536-542.
  • Muhammad Usman Khan, Muhammad Ibrahim, Muhammad Khalid, Munawar Saeed Qureshi, Tahsin Gulzar, Khalid Mahmood Zia, Abdulaziz A. Al-Saadi, Muhammad Ramzan Saeed Ashraf Janjua, “First theoretical probe for efficient enhancement of nonlinear optical properties of quinacridone based compounds through various modifications”, Chemical Physics Letters, 715 (2019) 222-230.
  • M.U. Khan, M. Ibrahim, M. Khalid, S. Jamil, A. A. Al-Saadi, M.R.S.A. Janjua, “Quantum chemical designing of indolo [3, 2, 1-jk] carbazole-based dyes for highly efficient nonlinear optical properties”, Chemical Physics Letters, 719 (2019) 59-66.
  • Ismail Abdulazeez, Aasem Zeino, Choon Wee Kee, Abdulaziz A. Al-Saadi, Mazen Khaled, Ming Wah Wong, Abdullah A. Al-Sunaidi, “Mechanistic studies of the influence of halogen substituents on the corrosion inhibitive efficiency of selected imidazole molecules: A synergistic computational and experimental approach”, Applied Surface Science, 471 (2019) 494-505.
  • Hakimu Nsubuga, Chanbasha Basheer, Almaz Jalilov, Muhammad Baseer Haider, Abdulaziz A. Al-Saadi, “Droplet flow-assisted heterogeneous electro-Fenton reactor for degradation of beta-blockers: response surface optimization, and mechanism elucidation”, Environmental Science and Pollution Research, 26 (2019) 14313-14327.
  • K. Haruna, Veena S. Kumar, Y. Sheena Mary, S. A. Popoola, Renjith Thomas, M. S. Roxy, A. A. Al-Saadi, “Conformational profile, vibrational assignments, NLO properties and molecular docking of biologically active herbicide1,1-dimethyl-3-phenylurea”, Heliyon, 5 (2019) e01987.
  • Azeem Rana, Mohammed S. M. Alghazal, Mohammed M. Alsaeedi, Rashed S. Bakdash, Chanbasha Basheer, Abdulaziz A. Al-Saadi, “Preparation and Characterization of Biomass Carbon–Based Solid Acid Catalysts for the Esterification of Marine Algae for Biodiesel Production”, BioEnergy Research, 12 (2019) 433-442.
  • Ismail Abdulazeez, Mazen Khaled, Abdulaziz A Al-Saadi, “Impact of electron-withdrawing and electron-donating substituents on the corrosion inhibitive properties of benzimidazole derivatives: A quantum chemical study”, Journal of Molecular Structure, 1196 (2019) 348-355.
  • Ismail Abdulazeez, Saheed A. Popoola, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “Spectroscopic, DFT and trace detection study of procaine using surface-enhanced Raman scattering technique”, Chemical Physics Letters, 730 (2019) 617-622.
  • Salawu Omobayo Adio, Azeem Rana, Basheer Chanabsha, Abdulmalik Adil Khalid BoAli, Mohammad Essa, Abdulaziz Alsaadi, “Silver Nanoparticle-Loaded Activated Carbon as an Adsorbent for the Removal of Mercury from Arabian Gas-Condensate”,Arabian Journal for Science and Engineering,  44, pages 6285–6293(2019).
  • Ditta ANawaz MahmoodMajeed MTahir Rashid Muddassar , Al-Saadi A,Byrne. “Principal components analysis of Raman spectral data for screening of Hepatitis C infectio”. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy,Vol-221,Pages:117-173,(2019).
  • Abdulaziz A Al-Saadi, “Understanding the Influence of Electron-Donating and Electron-Withdrawing Substituents on the Anticorrosive Properties of Imidazole: A Quantum-Chemical Approach”, Arabian Journal for Science and Engineering,Vol-45,Pages-153-166 (2020).
  • Ismail Abdulazeez, Othman C Al‐Hamouz, Mazen Khaled, Abdulaziz A Al‐Saadi, “New imidazole‐based dimers as potential inhibitors for mild steel corrosion in acidic media: Electrochemical and DFT evaluation”, Materials and Corrosion,Vol-71,Pages-292-299,issue-2 (2020).
  • K Haruna, Veena S Kumar, Sanja J Armaković, Stevan Armaković, Y Sheena Mary, Renjith Thomas, Saheed A Popoola, AR Almohammedi, MS Roxy, AA Al-Saadi, “Spectral characterization, thermochemical studies, periodic SAPT calculations and detailed quantum mechanical profiling various physico-chemical properties of 3, 4-dichlorodiuron”, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy,Vol-228,pages,117-580,(2020).
  • Rashed S Bakdash, Azeem Rana, Chanbasha Basheer, Abdulaziz A Al-Saadi, Mohammed AlSeedi, Isam H Aljundi, “Synthesis and Characterization of Fluorocarbon from Rice Husk and its Application as an Efficient Sorbent for Micro-Solid-Phase Extraction of N-Nitrosamines in Desalinated’’. Chromatographia,Vol-83,pages,95-105,(2020).
  • Ismail Abdulazeez, Othman Charles S Al‐Hamouz, Mazen Khaled, Abdulaziz A Al‐Saadi, “Inhibition of mild steel corrosion in CO2 and H2S‐saturated acidic media by a new polyurea‐based material, Materials and Corrosion’’,(2020).
  • A Al-Saadi, Muhammad Haroon, Saheed A Popoola, Tawfik A Saleh, “ Sensitive SERS detection and characterization of procaine in aqueous media by reduced gold nanoparticles’’, Sensors and Actuators B: Chemical”,Vol-304,pages:127057,(2020)
  • Nurudeen A Odewunmi, Mohammad A Jafar Mazumder, Shaikh A Ali, Norah A Aljeaban, Bader G Alharbi, Abdulaziz A Al-Saadi, Ime B Obot, “Impact of Degree of Hydrophilicity of Pyridinium Bromide Derivatives on HCl Pickling of X-60 Mild Steel: Experimental and Theoretical Evaluations”, Coatings,Vol-10,(2020) pages185.           
  • MS Abdelbassit, SA Popoola, TA Saleh, HH Abdallah, AA Al-Saadi, “DFT and Kinetic Evaluation of Chloromethane Removal Using Cost-Effective Activated Carbon”Arabian Journal for Science and Engineering, (2020)1-12.                                         
    • M Haroon, I Abdulazeez, TA Saleh, AA Al-Saadi “SERS-based trace-level       
    Quantification of sulindac: Spectroscopic and molecular modeling evaluation”Journal of Molecular Liquids, (2020) 113402.10     
  • Journal of Physics: Conference Series 1564 (1),(2020), 012008.
  1. AA Al-Saadi,“Computational study of SERS effects in some aliphatic and cyclic carboxylic acids with silver nanomaterials”

  2. Saheed A Popoola, Marwan HM Al-Harbi, Ahmed H Al-Rashidi, Mutaz SA Almarwani, Abdullah R Almohammedi, Abdulganiyu O Logunleko, Abdulaziz A Al-Saadi "DFT evaluation of the effects of OH, NH2 and Br substituents on the properties of 2,2′-bipyridine derivatives" . Journal of Taibah University for Science. 1527-1537(2020). 

  3. Abdulaziz A Al-Saadi, "Piloty’s acid and its hydrazide analogue: insights from the density functional theory and vibrational spectroscopy on the conformational stability and chemical reactivity”. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy.(2020) .

  4. Saheed A Popoola, Marwan HM Al-Harbi, Ahmed H Al-Rashidi, Mutaz SA Almarwani, Abdullah R Almohammedi, Abdulganiyu O Logunleko, Abdulaziz A Al-Saadi” DFT evaluation of the effects of OH, NH2 and Br substituents on the properties of 2,2′-bipyridine derivatives” Journal of Taibah University for Science.(2020) .

  5. MU Khan, R Hussain, M Yasir Mehboob, M Khalid, Z Shafiq, M Aslam, AA Al-Saadi,“In Silico Modeling of New “Y-Series”-Based Near-Infrared Sensitive Non-Fullerene Acceptors for Efficient Organic Solar Cells.ACS omega 5 (37), (2020),24125-24137 .

  6. Abdulaziz A Al-Saadi, Piloty’s acid and its hydrazide analogue: insights from the density functional theory and vibrational spectroscopy on the conformational stability and chemical reactivity” Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy.(2021).

  7. K Haruna, S Muthu, S Aayisha, A Peedikakal, AA Al-Saadi, “Molecular docking, spectroscopic, and quantum chemical studies on aromatic heterocycle tetrakis (4-pyridyl) cyclobutane regioisomers: potential membrane-permeable inhibitors”. Journal of Molecular Modeling,(2021) .

  8. Muhammad Haroon, Abdulaziz A Al-Saadi, Muhammad Adnan Iqbal” Comparative Exposure Assessment of Potential Health Risks through the Consumption of Vegetables Irrigated by Freshwater/Wastewater: Gujranwala, Pakistan” Chemical Research in Toxicology.(2021).   

  9. Mustapha Umar, Chidera C Nnadiekwe, Ismail Abdulazeez, Khalid Alhooshani, Abdulaziz A Al-Saadi” Nitrogen-Enhanced Charge Transfer Efficacy on the Carbon Sheet: A Theoretical Insight Into the Adsorption of Anionic Dyes” Arabian Journal for Science and Engineering (2021).

  10. Chidera C Nnadiekwe, Muhammad Haroon Ismail Abdulazeez, Qing Peng, Almaz Jalilov, Abdulaziz Al-Saadi,” Impact of polypyrrole functionalization on the anodic performance of boron nitride nanosheets: insights from first-principles calculations”. Frontiers in Chemistry(2021).

  11. Muhammad Haroon, Ismail Abdulazeez, Tawfik A Saleh, Abdulaziz A Al-Saadi” Electrochemically modulated SERS detection of procaine using FTO electrodes modified with silver-decorated carbon nanosphere” Electrochimica Acta(2021).

  12. Rashed S Bakdash, Isam H Aljundi, Chanbasha Basheer, Ismail Abdulazeez, Abdulaziz A Al‐Saadi” Porous Fluorocarbon from Rice Husk for the Efficient Separation of Gases” Global Challenges (2021). 

    Papers Published in Conference Proceedings:

    ·Abdulaziz A. Al-Saadi, W. Forner and H. M. Badawi, “Computational study of substituent effects and vibrational spectra of formyl haloketenes and formyl methylketene”, 1st Saudi Science Conference, King Fahd University of Petroleum & Minerals, Dhahran, Saudi Arabia, April 2001, 1st Saudi Science Conference Proceedings, 1 (2001) 307.

    · Vinod Kumar Gupta, Tawfik A. Saleh, Abdulaziz A. Al-Saadi, “A study of the characteristics of activated carbons produced from waste rubber tire and adsorption of cadmium”, AWER Procedia Advances in Applied Sciences, 1 (2013) 389-395. 1st Global Conference on Environmental Studies. (Journal title changed to Global Journal on Advances Pure and Applied Sciences)

    ·Mohammad Siddiqui, Nisar Ullah, Abdurrahman Al-Betar, Abdulaziz Al-Saadi, “Synthesis of functionalized polythiophene as a potential organic semi-conductor”, MATEC Web of Conferences, 49 (2016) 02001.


    ·Abdulaziz A. Al-Saadi, “Computational study of SERS effects in some aliphatic and cyclic carboxylic acids with silver nanomaterials”, Journal of Physics: Conference Series (JPCS), In press.

     Patents Registered:

    ·“Mixed ligand Gold(III) complexes as anti-cancer agents” by S. Al-Jaroudi, M. Altaf, A. A. Al-Saadi and A. A. Isab,  U.S. Patent No.: US 9481693 B1; Date of Patent Publication:  1st November, 2016.

    ·“Mixed ligand Gold(III) complexes and methods thereof” by S. Al-Jaroudi, M. Altaf, A. A. Al-Saadi and A. A. Isab,  U.S. Patent No.: US 9487542 B1; Date of Patent Publication:  8th  November, 2016.

    ·Method for treating a cancer with a mixed ligand gold (III) complexes as anti-cancer agents” by S. Al-Jaroudi, M. Altaf, A. A. Al-Saadi and A. A. Isab,  U.S. Patent No.: US 9585861; Date of Patent Publication:  7th Mar, 2017.

    ·“Method for treating prostate cancer and/or gastrointestinal cancer” by S. Al-Jaroudi, M. Altaf, A. A. Al-Saadi and A. A. Isab,  U.S. Patent No.: US 9649292; Date of Patent Publication:  16th May, 2017.

    ·“Method for detecting methimazole by surface-enhanced raman scattering” by Tawfik A. Saleh, Mutasem M. Al-shalafeh, Abdulaziz A. Al-Saadi, U.S. Patent No.: US; 15920115; Date of Patent Publication:  20th September, 2018.

    ·Inhibition of metal corrosion in aqueous media using a poly urea formulation” by I Abdulazeez, O Al-hamouz, A. Al-saadi, M Khaled, US Patent App.16/361,355.24th,Sept,2020.

    ·Efficient biomass carbon-based solid acid esterification catalyst for producing biodiesel.C Basheer, A Al-Saadi, MA Akbar, RS Bakdash.US Patent App. 16/425,257.(2020)

    ·Rotating sample platform for SERS analysis”TAS Awadh, A Al-Saadi.US Patent 10,883,873.(2020)

     ·Method for detecting copper (ii) ions using a hydrazone-based colorimetric sensor” Chanbasha Basheer, Abdulaziz A Al-saadi, Ismail Abdulazeez. US 2021/0109027 A1 (2020).

    Method of inhibiting metal corrosion with a piperazine-based polyurea”. Mazen Khaled, Abdulaziz A Al-saadi, Ismail Abdulazeez, AL-HAMOUZ Othman. US 2021/0115570 A1(2020). 

     Reviewer for the following journals:

  13.  Arabian Journal of Chemistry.     
  14.  Canadian Journal of Chemistry.     
  15.  Spectrochimica Acta Part A.      
  16.  Spectroscopy Letters.       
  17.  Chemical Data Collections.      
  18.  Structural Chemistry.     
  19.   Heliyon.
  20.  Journal of Molecular Structure