Find Research outputs

2023

A bismuth-based (III) hybrid perovskite as a highly air-stable, potential absorber with photoconductive response

Khan, A., Wen, H., Iqbal, S., Rehman, M. U., Shah, M., Raheel, M., Khan, F. A., Khan, R., Althobiti, R. A., Alzahrani, E., Farouk, A. E. A., Al-Fawzan, F. F. & Elkaeed, E. B., Sept 2023, In: Optical Materials. 143, 114228.

Research output: Journal Publication › Article › peer-review

2 Citations (Scopus)

Adhesive and Flame-Retardant Properties of Starch/Ca²⁺ Gels with Different Amylose Contents

Liu, P., Ling, J., Mao, T., Liu, F., Zhou, W., Zhang, G. & Xie, F., Jun 2023, In: Molecules. 28, 11, 4543.

Research output: Journal Publication › Article › peer-review

Open Access

14 Citations (Scopus)

A facile approach for the bio-fabrication of monometallic manganese oxide nano-catalyst for enhanced photocatalytic degradation of dyes and drug

Afzal, S., Shahid, S., Mansoor, S., Javed, M., Mahmood, S., Iqbal, S., Bahadur, A., Awwad, N. S. & Ibrahium, H. A., Dec 2023, In: Inorganic Chemistry Communication. 158, 111715.

Research output: Journal Publication › Article › peer-review

10 Citations (Scopus)

Biodiversity, Biochemical Profiling, and Pharmaco-Commercial Applications of Withania somnifera: A Review

Gaurav, H., Yadav, D., Maurya, A., Yadav, H., Yadav, R., Shukla, A. C., Sharma, M., Gupta, V. K. & Palazon, J., Feb 2023, In: Molecules. 28, 3, 1208.

Research output: Journal Publication › Review article › peer-review

Open Access

32 Citations (Scopus)

Carbon nanotubes modified reticulated vitreous carbon materials enhancing extracellular electron transfer of Shewanella loihica PV-4

Wang, H., Feng, L., Duan, Z., Marsili, E. & Zhang, X., 5 Nov 2023, In: Colloids and Surfaces A: Physicochemical and Engineering Aspects. 676, 132126.

Research output: Journal Publication › Article › peer-review

1 Citation (Scopus)

Deactivation of Cu SCR catalysts based on small-pore SSZ-13 zeolites: A review

Wang, B., Zhang, Y. & Fan, X., Jun 2023, In: Chemical Physics Impact. 6, 100207.

Research output: Journal Publication › Article › peer-review

Open Access

10 Citations (Scopus)

Degradation of flat-tube solid oxide electrolytic stack for co-electrolysis of H₂O and CO₂ under pulsed current

Wu, A., Han, B., Yao, Y., Zhang, Y., Tang, Y., Hanson, S., Wang, J., Guan, W. & Singhal, S. C., 1 Oct 2023, In: Journal of Power Sources. 580, 233372.

Research output: Journal Publication › Article › peer-review

7 Citations (Scopus)

Designing of Te-doped ZnO and S-g-C₃N₄ /Te-ZnO nano-composites as excellent photocatalytic and antimicrobial agents

Umar, M., Ajaz, H., Javed, M., Mansoor, S., Iqbal, S., Alhujaily, A., Bahadur, A., Althobiti, R. A., Alzahrani, E., Farouk, A. E. A., Al-Fawzan, F. F. & Elkaeed, E. B., 15 Nov 2023, In: Polyhedron. 245, 116664.

Research output: Journal Publication › Article › peer-review

17 Citations (Scopus)

Development of an Improved Kinetic Model for CO₂ Hydrogenation to Methanol

Mbatha, S., Thomas, S., Parkhomenko, K., Roger, A. C., Louis, B., Cui, X., Everson, R., Langmi, H., Musyoka, N. & Ren, J., Oct 2023, In: Catalysts. 13, 10, 1349.

Research output: Journal Publication › Article › peer-review

Open Access

3 Citations (Scopus)

Dynamic Disorder Drives Exciton Dynamics in Diketopyrrolopyrrole-Thiophene-Containing Molecular Crystals

Jiang, L., Hirst, J. D. & Do, H., 23 Mar 2023, In: Journal of Physical Chemistry C. 127, 11, p. 5519-5532 14 p.

Research output: Journal Publication › Article › peer-review

Open Access

3 Citations (Scopus)

Effects of Lipids and Type of Amino Acid in Protein in Microalgae on Nitrogen Reaction Pathways during Hydrothermal Liquefaction

Bao, T., Zhu, J., Zhang, N. & Shao, Y., Oct 2023, In: International Journal of Molecular Sciences. 24, 19, 14967.

Research output: Journal Publication › Article › peer-review

Open Access

Electronic circular dichroism of proteins computed using a diabatisation scheme

Rogers, D. M., Do, H. & Hirst, J. D., 2023, In: Molecular Physics. 121, 7-8, e2133748.

Research output: Journal Publication › Article › peer-review

Open Access

3 Citations (Scopus)

Enhanced large-scale production of recombinant phytase in E. coli DH5 α: Medium components optimization and thermodynamic studies

Nuge, T., Hayyan, A., Elgharbawy, A. A. M., Salleh, H. M., Jun Yong, Y., Kamarudin, A. F., Hizaddin, H. F., Zuhanis Has-Yun Hashim, Y., Liu, X., Saleh, J., Ibrahim Daoud, J., Aljohani, A. S. M., Alhumaydhi, F. A., Zulkifli, M. Y., Roslan Mohd Nor, M. & Al Abdulmonem, W., 15 Jan 2023, In: Journal of Molecular Liquids. 370, 120965.

Research output: Journal Publication › Article › peer-review

Open Access

3 Citations (Scopus)

Enhancing coking tolerance of flat-tube solid oxide fuel cells for direct power generation with nearly-dry methanol

Sang, J., Zhang, Y., Yang, J., Wu, T., Xiang, L., Wang, J., Guan, W., Chai, M. & Singhal, S. C., 1 Feb 2023, In: Journal of Power Sources. 556, 232485.

Research output: Journal Publication › Article › peer-review

12 Citations (Scopus)

Enhancing the performance of Quasi-2D perovskite blue light emitting diodes via a WS₂ energy matching layer

Zhang, B., Ding, S., Zhang, X., Qian, L. & Xiang, C., Sept 2023, In: Chemical Physics Letters. 826, 140671.

Research output: Journal Publication › Article › peer-review

1 Citation (Scopus)

Evaluation of ammonia co-firing in the CRIEPI coal jet flame using a three mixture fraction FPV-LES

Meller, D., Engelmann, L., Wollny, P., Tainaka, K., Watanabe, H., Debiagi, P. A., Stein, O. T. & Kempf, A. M., Jan 2023, In: Proceedings of the Combustion Institute. 39, 3, p. 3615-3624 10 p.

Research output: Journal Publication › Article › peer-review

18 Citations (Scopus)

Flamelet LES of a 40 kW_th pulverized torrefied biomass furnace in air and oxy-fuel atmospheres

Wen, X., Nicolai, H., Debiagi, P. A., Zabrodiec, D., Maßmeyer, A., Kneer, R. & Hasse, C., Jan 2023, In: Proceedings of the Combustion Institute. 39, 4, p. 4563-4572 10 p.

Research output: Journal Publication › Article › peer-review

7 Citations (Scopus)

Fully-resolved simulations of volatile combustion and NO_x formation from single coal particles in recycled flue gas environments

Shamooni, A., Stein, O. T., Kronenburg, A., Kempf, A. M., Debiagi, P. A., Li, T., Dreizler, A., Böhm, B. & Hasse, C., Jan 2023, In: Proceedings of the Combustion Institute. 39, 4, p. 4529-4539 11 p.

Research output: Journal Publication › Article › peer-review

5 Citations (Scopus)

Integration of WO₃-Doped MoO₃ with ZnO Photocatalyst for the Removal of 2-Nitrophenol in Natural Sunlight Illumination

Mateen, S., Nawaz, R., Qamar, M. T., Ali, S., Iqbal, S., Aslam, M., Raheel, M., Awwad, N. S. & Ibrahium, H. A., Sept 2023, In: Catalysts. 13, 9, 1262.

Research output: Journal Publication › Article › peer-review

Open Access

4 Citations (Scopus)

Interactions between Amorphous Silica and Sodium Alumino-Silicate Hydrate Gels: Insight from Reactive Molecular Dynamics Simulation

Guan, X., Xu, M., Li, B. & Do, H., 13 Jul 2023, In: Journal of Physical Chemistry C. 127, 27, p. 13302-13316 15 p.

Research output: Journal Publication › Article › peer-review

3 Citations (Scopus)

Ion rejection performances of functionalized porous graphene nanomembranes for wastewater purification: A molecular dynamics simulation study

Tabasi, E., Vafa, N., Firoozabadi, B., Salmankhani, A., Nouranian, S., Habibzadeh, S., Mashhadzadeh, A. H., Spitas, C. & Saeb, M. R., 5 Jan 2023, In: Colloids and Surfaces A: Physicochemical and Engineering Aspects. 656, 130492.

Research output: Journal Publication › Article › peer-review

12 Citations (Scopus)

Lightweight olefin block copolymers foams with shrinkable and recoverable performance via supercritical CO₂ foaming

Zheng, H., Huang, P., Lee, P. C., Chang, N. R. S., Zhao, Y., Su, Y., Wu, F., Liu, X. & Zheng, W., Sept 2023, In: Journal of Supercritical Fluids. 200, 105981.

Research output: Journal Publication › Article › peer-review

15 Citations (Scopus)

Molecular dynamics simulation of hexagonal boron nitride slit membranes for wastewater treatment

Vafa, N., Hamed Mashhadzadeh, A., Zarghami Dehaghani, M., Firoozabadi, B., Nouranian, S. & Spitas, C., 15 Jul 2023, In: Journal of Molecular Liquids. 382, 121842.

Research output: Journal Publication › Article › peer-review

4 Citations (Scopus)

Multi-scale design of MOF-based membrane separation for CO₂/CH₄ mixture via integration of molecular simulation, machine learning and process modeling and simulation

Cheng, X., Liao, Y., Lei, Z., Li, J., Fan, X. & Xiao, X., 15 Apr 2023, In: Journal of Membrane Science. 672, 121430.

Research output: Journal Publication › Article › peer-review

Open Access

37 Citations (Scopus)

Pluronic-123 Assisted Synthesis of Cobalt Vanadate Microparticles (µ-CoV MPs) for Durable Electrochemical Oxygen Evolution Reaction in Seawater and Connate Water

Khan, I., Mar 2023, In: Catalysts. 13, 3, 636.

Research output: Journal Publication › Article › peer-review

Open Access

8 Citations (Scopus)

Predicting bioactivity of antibiotic metabolites by molecular docking and dynamics

Chio, H., Guest, E. E., Hobman, J. L., Dottorini, T., Hirst, J. D. & Stekel, D. J., Sept 2023, In: Journal of Molecular Graphics and Modelling. 123, 108508.

Research output: Journal Publication › Article › peer-review

Open Access

9 Citations (Scopus)

Pt Nanoparticles on Beta zeolites for Catalytic Toluene Oxidation: Effect of the Hydroxyl Groups of Beta Zeolite**

Zou, R., Chansai, S., Xu, S., An, B., Zainal, S., Zhou, Y., Xin, R., Gao, P., Hou, G., D'Agostino, C., Holmes, S. M., Hardacre, C., Jiao, Y. & Fan, X., 8 Nov 2023, In: ChemCatChem. 15, 21, e202300811.

Research output: Journal Publication › Article › peer-review

Open Access

5 Citations (Scopus)

Recent advances in graphitic carbon nitride based electro-catalysts for CO₂ reduction reactions

Mao, X., Guo, R., Chen, Q., Zhu, H., Li, H., Yan, Z., Guo, Z. & Wu, T., 7 Apr 2023, In: Molecules. 28, 8, 3292.

Research output: Journal Publication › Review article › peer-review

Open Access

15 Citations (Scopus)

Regulation of fluorescent color and efficiency by molecular symmetry engineering of triphenylamine-based red emitters and their applications

Yan, Q., Yan, J., Zhou, J., Zhao, B., Guo, J., Chen, F., Li, J. & Wang, H., Feb 2023, In: Optical Materials. 136, 113435.

Research output: Journal Publication › Review article › peer-review

1 Citation (Scopus)

SnO₂-NPs (synthesized from crude rosmarinic acid) inhibit HeLa cells progression in vitro for anti-tumor investigation and act as an angiogenic inhibitor in ovo CAM xenograft

Sana, S. S., Pasha, A., Kumbhakar, D. V., Pawar, S. C., Li, H., Hou, T., Sharma, M., Gupta, V. K. & Zhang, Z., Feb 2023, In: Nano-Structures and Nano-Objects. 33, 100918.

Research output: Journal Publication › Article › peer-review

7 Citations (Scopus)

Strain induced electrochemical behaviors of ionic liquid electrolytes in an electrochemical double layer capacitor: Insights from molecular dynamics simulations

Roy, T., Goel, S., Costa, L. T., Titirici, M. M., Offer, G. J., Marinescu, M. & Wang, H., 28 Dec 2023, In: Journal of Chemical Physics. 159, 24, 244308.

Research output: Journal Publication › Article › peer-review

Open Access

1 Citation (Scopus)

Surface functionalized AuNCs optical biosensor as an emerging food safety indicator: Fundamental mechanism to future prospects

Mahmood Khan, I., Niazi, S., Akhtar, W., Yue, L., Pasha, I., Khan, M. K. I., Mohsin, A., Waheed Iqbal, M., Zhang, Y. & Wang, Z., 1 Jan 2023, In: Coordination Chemistry Reviews. 474, 214842.

Research output: Journal Publication › Review article › peer-review

50 Citations (Scopus)

Synthesis and characterization of highly efficient Te-doped Mn₃O₄ and s-g-C₃N₄ /Te- Mn₃O₄ nanocomposites as an excellent antimicrobial and photocatalytic agent

Umar, M., Ajaz, H., Javed, M., Iqbal, S., Shuaib Khan, M., Alhujaily, A., Awwad, N. S. & Ibrahium, H. A., Nov 2023, In: Inorganic Chemistry Communication. 157, 111353.

Research output: Journal Publication › Article › peer-review

13 Citations (Scopus)

The Emerging Role of MMP12 in the Oral Environment

Lin, B., Ser, H. L., Wang, L., Li, J., Chan, K. G., Lee, L. H. & Tan, L. T. H., Mar 2023, In: International Journal of Molecular Sciences. 24, 5, 4648.

Research output: Journal Publication › Review article › peer-review

Open Access

10 Citations (Scopus)

The Impact of Different Green Synthetic Routes on the Photocatalytic Potential of FeSnO₂ for the Removal of Methylene Blue and Crystal Violet Dyes under Natural Sunlight Exposure

Shaukat, A., Farrukh, M. A., Chong, K. K., Nawaz, R., Qamar, M. T., Iqbal, S., Awwad, N. S. & Ibrahium, H. A., Jul 2023, In: Catalysts. 13, 7, 1135.

Research output: Journal Publication › Article › peer-review

Open Access

9 Citations (Scopus)

Weldable and electrochemically stable composite of graphene and polyvinylidene fluoride as a current collector for promoting reversible lithium plating/stripping

Guo, Q., Wang, S., Li, Y., Wang, J., Wu, Y., Yu, Y., Xia, S., Hu, D., Hu, B., Ye, Z., Zhou, X., Chen, G. Z. & Liu, Z., 1 Oct 2023, In: Journal of Power Sources. 580, 233401.

Research output: Journal Publication › Article › peer-review

Open Access

1 Citation (Scopus)

β-l-Rhamnosylation and β-d-Mannosylation Mediated by 4-O-Ester Groups in a Weakly Nucleophilic Environment

Zhang, Y., Chen, C., Gao, Y., Yang, M., He, Z., Zhang, B., Gu, G., Tang, B. & Cai, F., 6 Oct 2023, In: Organic Letters. 25, 39, p. 7120-7125 6 p.

Research output: Journal Publication › Article › peer-review

6 Citations (Scopus)

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