Sadegh Kaviani | Computational chemistry | Best Researcher Award

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🌟Mr. Sadegh Kaviani , Civil Engineering, Best Researcher Award🏆

Sadegh Kaviani at Kazan Federal University, Russia

Sadegh Kaviani is a distinguished researcher specializing in computational materials science and physical chemistry, currently serving as a leading researcher at Kazan Federal University, Russia. He obtained his Ph.D. in Physical Chemistry from Ferdowsi University of Mashhad, Iran, where he investigated quantum mechanical aspects of nanochelators for treating iron overload disease. With a strong academic foundation including an M.Sc. in Physical Chemistry and a B.Sc. in Pure Chemistry from Islamic Azad University, North Tehran Branch, Kaviani’s research focuses on advancing theoretical understanding and practical applications of nanomaterials in energy storage and environmental remediation.

Author Metrics

Google Scholar Profile

Sadegh Kaviani has established a notable scholarly presence with numerous publications in esteemed journals such as Computational and Theoretical Chemistry, Journal of Molecular Liquids, and Journal of Power Sources. His research is widely cited, contributing significantly to the fields of computational chemistry, materials science, and nanotechnology, reflecting his expertise and impact in these areas.

  • Total Citations:
    • All-time: 532
    • Since 2019: 517
  • h-index:
    • All-time: 13
    • Since 2019: 13
  • i10-index (number of publications with at least 10 citations):
    • All-time: 22
    • Since 2019: 22

These metrics indicate Sadegh Kaviani’s impact in the academic community, reflecting both the breadth of his research output and the level of citation and recognition his work has received over time, particularly since 2019.

Education

Sadegh Kaviani pursued his academic journey with a B.Sc. in Pure Chemistry and an M.Sc. in Physical Chemistry from Islamic Azad University, North Tehran Branch. He completed his Ph.D. in Physical Chemistry at Ferdowsi University of Mashhad, Iran, where his doctoral thesis focused on quantum mechanical studies of nanochelators supervised by Prof. Mohammad Izadyar.

Research Focus

Sadegh Kaviani’s research is centered on computational materials science, encompassing solid state physics, density functional theory, molecular dynamic simulations, and the development of nanomaterials. His expertise extends to 2D materials, non-covalent interactions, nonlinear optical materials, metal-ion batteries (MIBs), and hydrogen storage systems. Kaviani applies a range of software tools such as Gaussian, Materials Studio, CASTEP, Dmol3, VMD, Avogadro, Multiwfn, and VESTA in his research endeavors.

Professional Journey

Sadegh Kaviani has a diverse professional journey, including roles as a post-doctoral researcher at Ferdowsi University of Mashhad and his current position as a leading researcher at Kazan Federal University. He also completed mandatory military service in Iran, showcasing his commitment to both academic pursuits and national responsibilities.

Publications Noted & Contributions

Sadegh Kaviani has authored significant publications that advance the understanding of nanomaterials, computational chemistry, and materials science. His contributions include studies on nanomaterials for photocatalytic applications, advanced anode materials for batteries, computational modeling of hydrogen storage, and quantum mechanical investigations into drug delivery nanocarriers.

Chitosan-based adsorptive membrane modified by carboxymethyl cellulose for heavy metal ion adsorption: Experimental and density functional theory investigations

  • Authors: M Khajavian, S Kaviani, I Piyanzina, DA Tayurskii, OV Nedopekin
  • Journal: International Journal of Biological Macromolecules
  • Volume: 257
  • Pages: 128706
  • Year: 2024

Zn-decorated S, P, B co-doped C2N nanosheet for ibuprofen adsorption: Experimental and density functional theory calculation

  • Authors: M Khajavian, S Kaviani, I Piyanzina, DA Tayurskii, OV Nedopekin
  • Journal: Colloids and Surfaces A: Physicochemical and Engineering Aspects
  • Volume: 680
  • Pages: 132702
  • Year: 2024

Two new dichroic dyes: Quantum chemical modeling, synthesis, optical properties and their application in polarizing films

  • Authors: S Shahab, H Yahyaei, M Sheikhi, L Filippovich, H Zhou, S Kaviani, …
  • Journal: Journal of Molecular Structure
  • Volume: 1239
  • Pages: 130353
  • Year: 2021

Amide-functionalized g-C3N4 nanosheet for the adsorption of arsenite (As3+): Process optimization, experimental, and density functional theory insight

  • Authors: M Khajavian, S Kaviani, I Piyanzina, DA Tayurskii, OV Nedopekin, …
  • Journal: Colloids and Surfaces A: Physicochemical and Engineering Aspects
  • Volume: 690
  • Pages: 133803
  • Year: 2024

A DFT-based design of B/N/P-co-doped oxo-triarylmethyl as a robust anode material for magnesium-ion batteries

  • Authors: S Kaviani, I Piyanzina, OV Nedopekin, DA Tayurskii, R Rahimi
  • Journal: Journal of Power Sources
  • Volume: 604
  • Pages: 234425
  • Year: 2024

A DFT study on the potential application of metal-encapsulated B12N12 nanocage for efficient removal of gemifloxacin in aqueous medium

  • Authors: ZM Shabavi, E Shakerzadeh, T Yadav, E Tahmasebi, S Kaviani, EC Anota
  • Journal: Computational and Theoretical Chemistry
  • Volume: 1234
  • Pages: 114535
  • Year: 2024

Theoretical design of transition metal-doped oxo-triarylmethyl as a disposable platform for adsorption of ibuprofen

  • Authors: S Kaviani, M Khajavian, I Piyanzina, OV Nedopekin, DA Tayurskii
  • Journal: Journal of Molecular Graphics and Modelling
  • Volume: 126
  • Pages: 108647
  • Year: 2024

These publications highlight Sadegh Kaviani’s research expertise in computational materials science, physical chemistry, and environmental applications, utilizing both experimental techniques and density functional theory (DFT) calculations.

Research Timeline

Sadegh Kaviani’s research timeline traces his academic progression through undergraduate and graduate studies to post-doctoral research and his current role as a leading researcher. His work consistently emphasizes the application of computational methods to solve critical challenges in materials science and chemistry.

Collaborations and Projects

Collaborations and specific projects led by Sadegh Kaviani are not detailed in the provided information. However, his research involves collaborations with various academic and research institutions to advance knowledge and innovation in computational materials science and physical chemistry.

Elina Marinho | Organic Chemistry | Best Researcher Award

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🌟Dr. Elina Marinho, Organic Chemistry, Best Researcher Award🏆

  •   Doctorate at University of Minho, Portugal 

Elina Margarida Ribeiro Marinho is a dedicated researcher with a strong academic background in chemistry and extensive experience in interdisciplinary research. She holds a Ph.D. in Sciences – Organic Chemistry from the University of Minho, where she also completed her Master’s degrees in Medicinal Chemistry. Elina’s research interests lie at the intersection of chemistry, materials science, and biomedical engineering, focusing on the synthesis of novel compounds and materials for various applications, including biomedical surfaces, drug delivery systems, and wound dressing. With a prolific publication record, numerous awards, and active involvement in research projects, Elina is committed to advancing scientific knowledge and contributing to the development of innovative solutions in her field.

Author Metrics

Scopus Profile

ORCID Profile

Elina Marinho’s research output is characterized by its quality and impact, as reflected in her author metrics. With a prolific publication record, she has established herself as a leading authority in her field, garnering recognition and citations for her contributions to scientific literature. Her work has been cited by peers and researchers worldwide, underscoring the significance of her research findings and the influence of her scholarly work.

Citations and Documents:

  • Citations: 51 citations by 45 documents
  • Documents: 10
  • h-index: 4

Elina R. Marinho has been cited 51 times across 45 documents. She has authored 10 documents, contributing to her h-index of 4. You can learn more about her research output and profile through her ORCID profile.

Education

Elina Marinho obtained her Ph.D. in Sciences – Organic Chemistry from the University of Minho, Portugal, in 2015. Prior to that, she completed her Master’s degrees in Medicinal Chemistry and earned her Bachelor’s degree in Chemistry from the same institution. Her academic journey equipped her with a solid foundation in chemistry and provided her with the necessary expertise to pursue her research interests.

Research Focus

Elina Marinho’s research focuses on several key areas, including the synthesis of heterocyclic compounds containing nitrogen and oxygen, chemical functionalization of carbon nanotubes and graphene, and engineering biomedical surfaces for bone repair and blood-contact medical devices. She also explores the development of novel drug delivery systems, localized multifunctional textiles for photodynamic cancer therapy, and dressing systems for wounds. Her work involves the design and fabrication of innovative materials using sustainable chemistry principles, with a particular emphasis on biodegradable polymer matrices and natural-based fibers.

Professional Journey

Throughout her career, Elina Marinho has held various research positions, demonstrating her commitment to academic excellence and scientific innovation. She served as a Postdoctoral Researcher at the Institute of Polymers and Composites (IPC) and the Institute of Nanostructures, Nanomodelling, and Nanofabrication (I3N) at the University of Minho from 2017 to 2021. Prior to that, she worked as a Ph.D. Researcher in the Department of Chemistry at the same university. Currently, she is engaged as a Researcher at the Centre for Textile Science and Technology (2C2T) of the School of Engineering, University of Minho, where she continues to pursue her research interests and contribute to scientific advancements in her field.

Honors & Awards

Elina Marinho has been recognized for her outstanding contributions to research with several awards and honors. Throughout her career, she has received seven awards and/or honors, acknowledging her significant achievements and impact in the field of chemistry and materials science.

Publications Noted & Contributions

Elina Marinho has made significant contributions to the scientific community through her publications and research output. She is the author of numerous peer-reviewed international research articles, book chapters, and conference proceedings, showcasing her expertise in various areas such as organic chemistry, materials synthesis, and biomedical engineering. Additionally, she has contributed to the development of patents, demonstrating her innovative approach to solving complex scientific challenges.

Clozapine: A special case of an atypical antipsychotic

  • Journal: European Journal of Medicinal Chemistry Reports
  • Date: February 2024
  • Type: Journal article
  • DOI: 10.1016/j.ejmcr.2024.100140
  • Contributors: Elina Marinho

One-Pot Reactions of Triethyl Orthoformate with Amines

  • Journal: Reactions
  • Date: December 2, 2023
  • Type: Journal article
  • DOI: 10.3390/reactions4040045
  • Contributors: Elina Marinho

Pullulan hydrogels as drug release platforms in biomedicine

  • Journal: Journal of Drug Delivery Science and Technology
  • Date: November 2023
  • Type: Journal article
  • DOI: 10.1016/j.jddst.2023.105066
  • Contributors: Marta O. Teixeira; Elina Marinho; Carla Silva; Joana C. Antunes; Helena P. Felgueiras

Poly(lactic acid) composites with few layer graphene produced by noncovalent chemistry

  • Journal: Polymer Composites
  • Date: November 2022
  • Type: Journal article
  • DOI: 10.1002/pc.27012
  • Contributors: Tânia Peixoto; Joana Nunes; Maria A. Lopes; Elina Marinho; M. Fernanda Proença; Paulo E. Lopes; Maria C. Paiva

Coaxial wet-spun fibers loaded with essential oils for wound healing applications

  • Event: iTechStyle Summit 2023 + ETP Conference
  • Date: May 9, 2023
  • Type: Conference poster
  • Contributors: Catarina S. Miranda; Elina Marinho; Susana P. G. Costa; Natália C. Homem ; Helena P. Felgueiras

Research Timeline

Elina Marinho’s research journey is marked by a series of milestones and achievements. From her early academic pursuits to her current position as a Researcher at the Centre for Textile Science and Technology, University of Minho, she has continually advanced her knowledge and expertise in chemistry, materials science, and biomedical engineering. Her research timeline highlights her dedication to scientific inquiry and her ongoing commitment to pushing the boundaries of knowledge in her field.