Updated on 2025/10/29

写真a

 
IBRAHIM Amgad ahmed ali
 
Organization
Institutes of Innovation for Future Society Institute of Materials Innovation Designated Assistant Professor
Title
Designated Assistant Professor
External link
 

Papers 18

  1. Extracting ORR Catalyst Information for Fuel Cell from Scientific Literature

    arXiv (Computation and Language – cs.CL)   Vol. (Pre-print)   2025.7

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    Language:English   Publishing type:Research paper (scientific journal)  

  2. Information Extraction of ORR Catalyst for Fuel Cell from Scientific Literature

    HTET HEIN, IBRAHIM AMGAD AHMED ALI, SASAKI YUTAKA, ASAHI RYOJI

    Proceedings of the Annual Conference of JSAI   Vol. JSAI2025 ( 0 ) page: 3K5IS2b03 - 3K5IS2b03   2025

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    Language:Japanese   Publisher:The Japanese Society for Artificial Intelligence  

    <p>The development of advanced catalysts for the Oxygen Reduction Reaction (ORR) is critical for improving the performance and efficiency of Polymer Electrolyte Fuel Cells (PEFCs). However, the vast and growing body of scientific literature poses challenges for researchers aiming to identify key insights. This study focuses on the information extraction of ORR catalysts from fuel cell-related literature using a hybrid approach combining manual annotation and automated machine learning techniques. A comprehensive dataset was constructed through the Brat annotation tool, identifying 12 critical entities such as <i>catalyst</i>, <i>support</i>, and <i>value</i>, alongside two relationship types: <i>equivalent </i>and <i>related_to</i>. The annotated data was used to fine-tune the DyGIE++ framework with the pre-trained BERT models. The model demonstrated effective performance in extracting complex material science concepts and their interrelationships. The finding suggests that this automated framework can accelerate catalyst discovery by providing structured, high-quality data for downstream analysis. This research highlights the potential of Natural Language Processing (NLP) in enabling efficient literature mining and fostering advancements in clean energy techniques.</p>

    DOI: 10.11517/pjsai.jsai2025.0_3k5is2b03

    CiNii Research

  3. Computational Analysis of the Optical and Charge Transport Properties of Ultrasonic Spray Pyrolysis-Grown Zinc Oxide/Graphene Hybrid Structures Reviewed Open Access

    Ali A., Hashim A.

    Nanoscale Research Letters   Vol. 11 ( 1 )   2016

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:Nanoscale Research Letters  

    We demonstrate a systematic computational analysis of the measured optical and charge transport properties of the spray pyrolysis-grown ZnO nanostructures, i.e. nanosphere clusters (NSCs), nanorods (NRs) and nanowires (NWs) for the first time. The calculated absorbance spectra based on the time-dependent density functional theory (TD-DFT) shows very close similarity with the measured behaviours under UV light. The atomic models and energy level diagrams for the grown nanostructures were developed and discussed to explain the structural defects and band gap. The induced stresses in the lattices of ZnO NSCs that formed during the pyrolysis process seem to cause the narrowing of the gap between the energy levels. ZnO NWs and NRs show homogeneous distribution of the LUMO and HOMO orbitals all over the entire heterostructure. Such distribution contributes to the reduction of the band gap down to 2.8 eV, which has been confirmed to be in a good agreement with the experimental results. ZnO NWs and NRs exhibited better emission behaviours under the UV excitation as compared to ZnO NSCs and thin film as their visible range emissions are strongly quenched. Based on the electrochemical impedance measurement, the electrical models and electrostatic potential maps were developed to calculate the electron lifetime and to explain the mobility or diffusion behaviours in the grown nanostructure, respectively.

    DOI: 10.1186/s11671-016-1466-x

    Open Access

    Scopus

  4. Density Functional Theory Study of Atomic Layer Deposition of Zinc Oxide on Graphene Reviewed Open Access

    Ali A.A., Hashim A.M.

    Nanoscale Research Letters   Vol. 10 ( 1 )   2015.12

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:Nanoscale Research Letters  

    The dissociation of zinc ions (Zn<sup>2+</sup>) from vapor-phase zinc acetylacetonate, Zn(C<inf>5</inf>H<inf>7</inf>O<inf>2</inf>)<inf>2</inf>, or Zn(acac)<inf>2</inf> and its adsorption onto graphene oxide via atomic layer deposition (ALD) were studied using a quantum mechanics approach. Density functional theory (DFT) was used to obtain an approximate solution to the Schrödinger equation. The graphene oxide cluster model was used to represent the surface of the graphene film after pre-oxidation. In this study, the geometries of reactants, transition states, and products were optimized using the B3LYB/6-31G** level of theory or higher. Furthermore, the relative energies of the various intermediates and products in the gas-phase radical mechanism were calculated at the B3LYP/6-311++G** and MP2/6-311 + G(2df,2p) levels of theory. Additionally, a molecular orbital (MO) analysis was performed for the products of the decomposition of the Zn(acac)<inf>2</inf> complex to investigate the dissociation of Zn<sup>2+</sup> and the subsequent adsorption of H atoms on the C<inf>5</inf>H<inf>7</inf>O<inf>2</inf> cluster to form acetylacetonate enol. The reaction energies were calculated, and the reaction mechanism was accordingly proposed. A simulation of infrared (IR) properties was performed using the same approach to support the proposed mechanism via a complete explanation of bond forming and breaking during each reaction step.

    DOI: 10.1186/s11671-015-1008-y

    Open Access

    Scopus

  5. Seed/Catalyst-Free Growth of Gallium-Based Compound Materials on Graphene on Insulator by Electrochemical Deposition at Room Temperature Reviewed Open Access

    Rashiddy Wong F., Ahmed Ali A., Yasui K., Hashim A.M.

    Nanoscale Research Letters   Vol. 10 ( 1 )   2015.12

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Nanoscale Research Letters  

    We report the growth of gallium-based compounds, i.e., gallium oxynitride (GaON) and gallium oxide (Ga<inf>2</inf>O<inf>3</inf>) on multilayer graphene (MLG) on insulator using a mixture of ammonium nitrate (NH<inf>4</inf>NO<inf>3</inf>) and gallium nitrate (Ga(NO<inf>3</inf>)<inf>3</inf>) by electrochemical deposition (ECD) method at room temperature (RT) for the first time. The controlling parameters of current density and electrolyte molarity were found to greatly influence the properties of the grown structures. The thicknesses of the deposited structures increase with the current density since it increases the chemical reaction rates. The layers grown at low molarities of both solutions basically show grain-like layer with cracking structures and dominated by both Ga<inf>2</inf>O<inf>3</inf> and GaON. Such cracking structures seem to diminish with the increases of molarities of one of the solutions. It is speculated that the increase of current density and ions in the solutions helps to promote the growth at the area with uneven thicknesses of graphene. When the molarity of Ga(NO<inf>3</inf>)<inf>3</inf> is increased while keeping the molarity of NH<inf>4</inf>NO<inf>3</inf> at the lowest value of 2.5 M, the grown structures are basically dominated by the Ga<inf>2</inf>O<inf>3</inf> structure. On the other hand, when the molarity of NH<inf>4</inf>NO<inf>3</inf> is increased while keeping the molarity of Ga(NO<inf>3</inf>)<inf>3</inf> at the lowest value of 0.8 M, the GaON structure seems to dominate where their cubic and hexagonal arrangements are coexisting. It was found that when the molarities of Ga(NO<inf>3</inf>)<inf>3</inf> are at the high level of 7.5 M, the grown structures tend to be dominated by Ga<inf>2</inf>O<inf>3</inf> even though the molarity of NH<inf>4</inf>NO<inf>3</inf> is made equal or higher than the molarity of Ga(NO<inf>3</inf>)<inf>3</inf>. When the grown structure is dominated by the Ga<inf>2</inf>O<inf>3</inf> structure, the deposition process became slow or unstable, resulting to the formation of thin layer. When the molarity of Ga(NO<inf>3</inf>)<inf>3</inf> is increased to 15 M, the nanocluster-like structures were formed instead of continuous thin film structure. This study seems to successfully provide the conditions in growing either GaON-dominated or Ga<inf>2</inf>O<inf>3</inf>-dominated structure by a simple and low-cost ECD. The next possible routes to convert the grown GaON-dominated structure to either single-crystalline GaN or Ga<inf>2</inf>O<inf>3</inf> as well as Ga<inf>2</inf>O<inf>3</inf>-dominated structure to single-crystalline Ga<inf>2</inf>O<inf>3</inf> structure have been discussed.

    DOI: 10.1186/s11671-015-0943-y

    Open Access

    Scopus

  6. Evolution of Zinc Oxide Nanostructures Grown on Graphene by Ultrasonic Spray Pyrolysis and Its Statistical Growth Modelling Reviewed Open Access

    Ali A., Hashim A.

    Nanoscale Research Letters   Vol. 10 ( 1 ) page: 1 - 13   2015.12

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:Nanoscale Research Letters  

    The evolution of zinc oxide nanostructures grown on graphene by alcohol-assisted ultrasonic spray pyrolysis was investigated. The evolution of structures is strongly depended on pyrolysis parameters, i.e., precursor molarity, precursor flow rate, precursor injection/deposition time, and substrate temperature. Field-effect scanning electron microscope analysis, energy dispersive X-ray spectroscopy, X-ray diffraction, and transmission electron microscopy were used to investigate the properties of the synthesized nanostructures and to provide evidence for the structural changes according to the changes in the pyrolysis parameters. The optimum parameters to achieve maximum density and well-defined hexagonally shaped nanorods were a precursor molarity of 0.2 M, an injection flow rate of 6 ml/min, an injection time of 10 min, and a substrate temperature of 250–355 °C. Based on the experimental results, the response surface methodology (RSM) was used to model and optimize the independent pyrolysis parameters using the Box-Behnken design. Here, the responses, i.e., the nanostructure density, size, and shape factor, are evaluated. All of the computations were performed using the Design-Expert software package. Analysis of variance (ANOVA) was used to evaluate the results of the model and to determine the significant values for the independent pyrolysis parameters. The evolution of zinc oxide (ZnO) structures are well explained by the developed modelling which confirms that RSM is a reliable tool for the modelling and optimization of the pyrolysis parameters and prediction of nanostructure sizes and shapes.

    DOI: 10.1186/s11671-015-1163-1

    Open Access

    Scopus

  7. Modeling and optimization aspects of radiation induced grafting of 4-vinylpyridene onto partially fluorinated films Reviewed

    Nasef M., Ahmad Ali A., Saidi H., Ahmad A.

    Radiation Physics and Chemistry   Vol. 94 ( 1 ) page: 123 - 128   2014.1

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Radiation Physics and Chemistry  

    Modeling and optimization aspects of radiation induced grafting (RIG) of 4-vinylpyridine (4-VP) onto partially fluorinated polymers such as poly(ethylene-. co-tetrafluoroethene) (ETFE) and poly(vinylidene fluoride) (PVDF) films were comparatively investigated using response surface method (RSM). The effects of independent parameters: absorbed dose, monomer concentration, grafting time and reaction temperature on the response, grafting yield (GY) were correlated through two quadratic models. The results of this work confirm that RSM is a reliable tool not only for optimization of the reaction parameters and prediction of GY in RIG processes, but also for the reduction of the number of the experiments, monomer consumption and absorbed dose leading to an improvement of the overall reaction cost. © 2013 Elsevier Ltd.

    DOI: 10.1016/j.radphyschem.2013.05.049

    Scopus

  8. Optimization and kinetics of phosphoric acid doping of poly(1-vinylimidazole)-graft-poly(ethylene-co-tetrafluorethylene) proton conducting membrane precursors Reviewed

    Mahmoud Nasef M., Saidi H., Ahmad A., Ahmad Ali A.

    Journal of Membrane Science   Vol. 446   page: 422 - 432   2013.11

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:Journal of Membrane Science  

    Optimization of the reaction parameters affecting phosphoric acid (PA) doping behavior of poly(1-vinylimidazole), P(VIm), grafted poly(ethylene-co-tetrafluoroethylene) (ETFE) proton conducting membrane precursors obtained by radiation induced grafting was studied using the Taguchi method. The reaction parameters such as degree of grafting (G%) in the precursors, PA concentration, temperature and doping time were selected as independent parameters while doping level was the response. The optimum parameters for achieving the maximum doping level (7.45mmolrepeat polymer unit<sup>-1</sup>) were: G% of 54%, PA concentration of 60%, temperature of 100°C and reaction time of 5 days. The kinetics of the acid doping reaction was also studied and the doping rate was found to be a function of reaction parameters and followed a first order reaction. The PA doping was verified by Fourier transform infrared (FTIR) and X-ray photoelectron spectroscopy (XPS) analysis of the membranes. The proton conductivity and thermal stability of the membranes were also evaluated. It can be concluded that the Taguchi method provides an effective tool for prediction of acid doping level and optimization of reaction parameters. The kinetics of acid doping is also suggested to be a diffusion-driven reaction following a multi-layers adsorption model. © 2013 Elsevier B.V.

    DOI: 10.1016/j.memsci.2013.05.053

    Scopus

  9. Composite proton conducting membrane by radiation-induced grafting of 1-vinylimidazole onto poly(ethylene-co-tetrafluoroethylene) and phosphoric acid doping Reviewed

    Nasef M., Ali A., Saidi H.

    High Performance Polymers   Vol. 25 ( 2 ) page: 198 - 204   2013.3

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:High Performance Polymers  

    Composite membrane containing phosphoric acid (PA) for possible use in a fuel cell was prepared by radiation-induced grafting of 1-vinylimidazole (1-VIm) onto poly(ethylene-co-tetrafluoroethylene) (ETFE) films followed by protonation with PA doping. The preparation procedure involved three steps: (i) irradiation of ETFE films by an electron beam, (ii) grafting of 1-VIm onto the irradiated films under selected conditions and (iii) doping the grafted film with PA. The membrane composition, thermal properties and thermal stability were evaluated using Fourier-transformed infrared spectroscopy, thermogravimetric analysis and differential scanning calorimetry, respectively. The obtained membrane was found to have a degree of grafting of 54% and 6.6 mmol PA per poly-VIm repeating unit with ionic conductivity of 140 mS cm-1 at 120 C and ∼20% relative humidity. The overall results suggest that the membrane has a promising combination of physicochemical properties appealing for possible application in polymer electrolyte membrane fuel cell above 100 C. © The Author(s) 2012.

    DOI: 10.1177/0954008312460065

    Scopus

  10. Modeling, prediction, and multifactorial optimization of radiation-induced grafting of 4-vinylpyridine onto poly(vinylidene fluoride) films using statistical simulator Reviewed

    Nasef M.M., Shamsaei E., Ghassemi P., Aly A.A., Yahaya A.H.

    Journal of Applied Polymer Science   Vol. 127 ( 3 ) page: 1659 - 1666   2013.2

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Journal of Applied Polymer Science  

    The traditional method for obtaining best combination of reaction parameters for graft copolymerization of 4-vinylpyridine onto poly(vinylidene fluoride) films was modified using Box-Behnken factorial design available in the response surface method (RSM). A computer-assisted statistical simulator was used to obtain the optimum absorbed dose, monomer concentration, grafting time and reaction temperature to achieve the highest degree of grafting (G%) based a quadratic model. The validity of the developed model was confirmed by experimental data, which only deviated by a 2% from the predicted value of G% confirming the effectiveness of RSM in optimization of the reaction parameters in the present grafting system. A comparison was also made between the obtained model and that of 1-vinylimidazole/poly(ethylene-co-tetrafluoroethylene) grafting system. The chemical structure, morphology and thermal stability of the obtained graft copolymers was investigated by means of Fourier transform infrared, filed emission scanning electron microscope, and thermogravimetric analysis, respectively. © 2012 Wiley Periodicals, Inc.

    DOI: 10.1002/app.37558

    Scopus

  11. Water and charge transport models in proton exchange membranes: An overview Invited Reviewed

    Nasef M., Aly A.

    Desalination   Vol. 287   page: 238 - 246   2012.11

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Desalination  

    Recently, the significant role of water management in affecting the performance and durability of proton exchange membrane fuel cell (PEMFC) has been subjective to an intensive research to understand water transport phenomena which is marked by two processes: water adsorption and water diffusion. Various mathematical models have been developed to address both processes on a different basis. This article briefly reviews various water transport models in a comparative manner to have a better understanding on the role of water hydration with respect to membrane structure and transport mechanism, in affecting the proton transport in the membranes. A discussion on the validity and reliability of the models for describing the water management is also presented. The limitations that are required to be overcome to design new materials meeting the new trends of membranes development for fuel cell are also highlighted. © 2011 Elsevier B.V.

    DOI: 10.1016/j.desal.2011.06.054

    Scopus

  12. Optimization of reaction parameters of radiation induced grafting of 1-vinylimidazole onto poly(ethylene-co-tetraflouroethene) using response surface method

    Nasef M., Aly A., Saidi H., Ahmad A.

    Radiation Physics and Chemistry   Vol. 80 ( 11 ) page: 1222 - 1227   2011.11

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    Authorship:Lead author   Language:English   Publishing type:Research paper (scientific journal)   Publisher:Radiation Physics and Chemistry  

    Radiation induced grafting of 1-vinylimidazole (1-VIm) onto poly(ethylene-co-tetraflouroethene) (ETFE) was investigated. The grafting parameters such as absorbed dose, monomer concentration, grafting time and temperature were optimized using response surface method (RSM). The Box-Behnken module available in the design expert software was used to investigate the effect of reaction conditions (independent parameters) varied in four levels on the degree of grafting (G%) (response parameter). The model yielded a polynomial equation that relates the linear, quadratic and interaction effects of the independent parameters to the response parameter. The analysis of variance (ANOVA) was used to evaluate the results of the model and detect the significant values for the independent parameters. The optimum parameters to achieve a maximum G% were found to be monomer concentration of 55 vol%, absorbed dose of 100 kGy, time in the range of 14-20 h and a temperature of 61. °C. Fourier transform infrared (FTIR), thermogravimetric analysis (TGA) and differential scanning calorimetry (DSC) were used to investigate the properties of the obtained films and provide evidence for grafting. © 2011 Elsevier Ltd.

    DOI: 10.1016/j.radphyschem.2011.06.014

    Scopus

  13. Molecular structures of cooking palm oil in gas phase modelled by density functional theory Reviewed

    Maarof S., Ali A.A., Hashim A.M.

    Materials Today Proceedings   Vol. 7   page: 770 - 775   2019

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Materials Today Proceedings  

    In recent year, there are several reports on the growth of carbon nanotube (CNT) and graphene using a natural source, namely cooking palm oil. However, the accurate geometry and composition of the palm oil molecules are rarely found in literature. In this article, a molecular model is proposed to predict the geometry and molecular structure of the cooking palm oil using density functional theory (DFT) in correlation with other quantum chemistry calculations. Such model is expected to help the researcher in the design of chemical reactions needed for the deposition carbon nanomaterials by chemical vapor deposition (CVD) or pyrolysis. The results of the computational analysis were validated and confirmed to be in good agreement with the measured Fourier transformed infrared (FTIR) and proton nuclear magnetic resonance (1H-NMR) spectra.

    DOI: 10.1016/j.matpr.2018.12.073

    Scopus

  14. Synthesis of Large-Area Single-Layer Graphene Using Refined Cooking Palm Oil on Copper Substrate by Spray Injector-Assisted CVD Open Access

    Maarof S., Ali A.A., Hashim A.M.

    Nanoscale Research Letters   Vol. 14   2019

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    Publishing type:Research paper (scientific journal)   Publisher:Nanoscale Research Letters  

    We present a synthesis of large-area single-layer graphene on copper substrate using a refined cooking palm oil, a natural single carbon source, by a home-made spray injector-assisted chemical vapor deposition system. The effects of the distance between spray nozzle and substrate, and growth temperature are studied. From Raman mapping analysis, shorter distance of 1 cm and temperature of around 950 °C lead to the growth of large-area single-layer graphene with a coverage up to 97% of the measured area size of 6400 μm<sup>2</sup>. The crystallinity of the grown single layer graphene is relatively good due to high distribution percentage of FWHM values of 2D band that is below 30 cm<sup>−1</sup>. However, the defect concentration is relatively high, and it suggests that a flash-cooling technique needs to be introduced.

    DOI: 10.1186/s11671-019-2976-0

    Open Access

    Scopus

  15. A short review of architecture and computational analysis in the design of graphene-based bioelectronic devices Open Access

    Ibrahim A.A.A., Ibrahim N.N.N.M., Centeno A., Hashim A.M.

    Sensors and Materials   Vol. 30 ( 6 ) page: 1231 - 1252   2018

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    Publishing type:Research paper (scientific journal)   Publisher:Sensors and Materials  

    Graphene possesses a high surface-to-volume ratio, which enables biomolecules to attach to it for bioelectronic applications. In this article, first, the classification and applications of bioelectronic devices are briefly reviewed. Then, recent work on real fabricated graphene-based bioelectronic devices as well as the analysis of their architecture and design using a computational approach to their charge transport properties are presented and discussed. A comparison to nongraphitic bioelectronic devices is also given. On the macroscale level, the design of devices is elaborated on the basis of a finite element analysis (FEA) approach, and the impact of design on the performance of the devices is discussed. On the nanoscale level, transport phenomena and their mechanisms for different design categories are elaborated on the basis of the density functional theory (DFT) and other quantum chemistry calculations. The calculated and measured charge transport properties of graphene-based bioelectronic devices are also compared with those of other available bioelectronic devices.

    DOI: 10.18494/SAM.2018.1805

    Open Access

    Scopus

  16. Transport properties and sensing responses of platinum nanoparticles/graphene structure fabricated by thermal annealing process Invited Reviewed Open Access

    Sanif M.S.M., Ali A.A., Woon L.M., Wah L.H., Sheng D.B.C., Hashim A.M.

    Sains Malaysiana   Vol. 46 ( 7 ) page: 1119 - 1124   2017.7

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    Language:English   Publishing type:Research paper (scientific journal)   Publisher:Sains Malaysiana  

    The effects of the annealing temperatures and thicknesses on the shapes, sizes and arrangement of platinum (Pt) nanoparticles (NPs) on graphene and their sensing performance for hydrogen (H2) detection were investigated. It shows strong dependency of the annealing temperatures and thicknesses on the properties of NPs. It was found that the proposed technique is able to form the NPs with good size controllability and uniformity even for thick deposited layer, thus eliminating the requirement of very thin layer of below 5 nm for the direct NP synthesis by evaporation or sputtering. The transport properties of Pt NPs/graphene structure and its sensing performance on H2 at room temperature under various H2 concentration were evaluated. The results showed an acceptable sensing response, indicating an innovative approach to fabricate Pt NPs embedded graphene for gas sensing application.

    DOI: 10.17576/jsm-2017-4607-15

    Open Access

    Scopus

  17. Preparation and characterization of poly(1-vinyl imidazole)-graft-ETFE/phosphoric acid proton conducting membranes

    Ali A.A., Nasef M.M., Saidi H., Ahmad A.

    Jurnal Teknologi   Vol. 75 ( 6 ) page: 95 - 102   2015.8

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    Publishing type:Research paper (scientific journal)   Publisher:Jurnal Teknologi  

    Proton conducting membranes obtained by radiation-induced grafting (RIG) of 1-vinylimidazole (1-VIm) onto poly(ethylene-co-tetraflouroethene) (ETFE) films followed by phosphoric acid (PA) doping was prepared. The effect of grafting parameters on the grafted basic moiety was studied. The level of PA doping was controlled by manipulation of reaction parameters. The obtained membranes were investigated with Fourier transform infrared spectroscopy (FTIR), thermal gravimetric analysis (TGA), differential scanning calorimeter (DSC) and DC impedance spectroscopy. The obtained membranes proved to have less-water dependent proton conductivity with a value of 140 mS/cm at 120oC and 17% RH% at acid doping level of of 6.54 mmol/repeat unit. The membranes have potential for application in high temperature polymer electrolyte membrane fuel cell (PEMFC).

    Scopus

  18. Optimization strategies for radiation induced grafting of 4-vinylpyridine onto poly(ethylene-co-tetraflouroethene) film using Box-Behnken design

    Mahmoud Nasef M., Shamsaei E., Ghassemi P., Ahmed Aly A., Hamid Yahaya A.

    Radiation Physics and Chemistry   Vol. 81 ( 4 ) page: 437 - 444   2012.4

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    Publishing type:Research paper (scientific journal)   Publisher:Radiation Physics and Chemistry  

    The radiation induced grafting of 4-vinylpyridine (4-VP) onto poly(ethylene-co-tetrafluoroethene) (ETFE) was optimized using the Box-Behnken factorial design available in the response surface method (RSM). The optimized grafting parameters; absorbed dose, monomer concentration, grafting time and reaction temperature were varied in four levels to quantify their effect on the grafting yield (GY). The validity of the statistical model was supported by the small deviation between the predicted (GY=61%) and experimental (GY=57%) values. The optimum conditions for enhancing. GY were determined at the following values: monomer concentration of 48. vol%, absorbed dose of 64. kGy, reaction time of 4. h and temperature of 68. °C. A comparison was made between the optimization model developed for the present grafting system and that for grafting of 1-vinylimidazole (1-VIm) onto ETFE to confirm the validly and reliability of the Box-Behnken for the optimization of various radiation induced grafting reactions. Fourier transform infrared (FTIR), thermogravimetric analysis (TGA) and X-ray diffraction (XRD) were used to investigate the properties of the obtained films and provide evidence for grafting. © 2011 Elsevier Ltd.

    DOI: 10.1016/j.radphyschem.2011.12.019

    Scopus

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Presentations 4

  1. Technical Meeting on Radiation-induced Grafting Technology for Industry and Environment Invited International coauthorship International conference

    IBRAHIM Amgad ahmed ali

    Towards Accelerated Design for Radiation-Induced Grafting Using Stochastic-Probabilistic Inversion Approach  International Atomic Energy Agency (IAEA)

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    Event date: 2024.9 - 2024.10

    Language:English   Presentation type:Oral presentation (invited, special)  

    Country:Austria  

    Functional polymers are essential materials due to their specific properties, which can be tailored by controlling the synthesis process conditions. Rapidly discovering optimal conditions for preparing functional polymers is crucial, yet challenging due to the high costs of experimentation and computation. Machine learning (ML) models significantly accelerate the discovery of optimal conditions for synthetic experiments and enable comprehensive design of experiments (DOE). Traditional systematic experimental design, while common, requires numerous experiments to cover the parameter space adequately, often missing the optimal conditions. This study proposes an alternative experimental design approach that accelerates and accurately discovers optimal preparation conditions for functional polymers.
    A major limitation of polynomial regression models based on DOE is their reliance on polynomial models (PR), which fail to provide accurate approximations in highly nonlinear problems. In contrast, stochastic processes (SP) are known for their accurate approximation of various functions. By merging PR and SP, we can overcome the shortcomings of PR and achieve precise predictions. Probabilistic inversion (PI), a framework for global optimization of costly objective functions, is extensively used with SP to minimize the number of slow and costly function evaluations. This study compares the predictability of the combined SP-PI approach with that of PR, demonstrating the effectiveness of ML in optimizing the preparation conditions for functional polymers.
    To our knowledge, the detailed effects of grafting parameters on grafting yield (Gy) at high absorbed doses using γ-ray sources, and their optimization via machine learning, have not been previously reported. Radiation-induced grafting (RIG) generally faces reproducibility challenges, with standard deviations of recorded results exceeding 5%, indicating that identical experimental conditions do not always yield consistent results. This variability introduces uncertainty in predictions, which can be mitigated using SP to appropriately address these uncertainties.

  2. Introduction to Stochastic Process, Space-Filling Designs for Modelling Systems Invited International conference

    IBRAHIM Amgad ahmed ali

    Radiation Processing Webinar Series 3: Towards Design of Experiments for Radiation-Induced Grafting Using Stochastic Methods  2024.7.18  International Atomic Energy Agency (IAEA)

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    Event date: 2024.7

    Language:English   Presentation type:Public lecture, seminar, tutorial, course, or other speech  

    Venue:International Atomic Energy Agency (IAEA)-Online   Country:Austria  

  3. Introduction to Machine Learning; Machine Learning: Basic Concepts; Case Studies: Material Synthesis Invited International conference

    IBRAHIM Amgad ahmed ali

    Radiation Processing Webinar Series 2: Towards Data-driven Optimization of Radiation-Induced Grafting  2024.6.19  International Atomic Energy Agency (IAEA)

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    Event date: 2024.6

    Language:English   Presentation type:Public lecture, seminar, tutorial, course, or other speech  

    Venue:International Atomic Energy Agency (IAEA)-Online   Country:Austria  

  4. Introduction to Response Surface Methodology (RSM); Advanced Analysis in Response Surface Methodology Invited International conference

    IBRAHIM Amgad ahmed ali

    Radiation Processing Webinar Series 1: Experimental Design for Radiation-Induced Grafting Modelling and Optimization  2024.5.16  International Atomic Energy Agency (IAEA)

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    Event date: 2024.5

    Language:English   Presentation type:Public lecture, seminar, tutorial, course, or other speech  

    Venue:International Atomic Energy Agency (IAEA)- Online   Country:Austria