プロフィール詳細

プロジェクトを作成

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Parisa N.に依頼

Belgium

PhD in Computational Chemistry with +10 years of research experience, academic article writing, book and grant writing

プロフィール概要

I am a senior researcher with a doctoral degree in Computational Chemistry for gas and energy conversion and two master's diplomas in Nanochameistry and Inorganic Chemistry. I have over +10 years of experience working in computational photoelectrocatalysis, surface science, materials design, and heterogeneous catalysis. I help students, researchers, and publishers refine research papers, theses, and journal submissions through meticulous editing and revision. With years of academic research, writing, and editing, working as an editor, and publication experiences, I ensure clarity, accuracy, and adherence to publication standards in every document. *Dominant in DFT, VASP, Gaussian, programming with Python, data analysis, and data visualization * Project management and time management from start to finish * I am accurate, strict, and sensitive in writing a clean text. So, I assured that reviewers will not object to the language of your manuscript or thesis.

専門分野

• ★ Catalysis
• ★ Surface Science
• ★ Computational Chemistry
• ☆ Electrochemistry
• ☆ Data Analysis
• ☆ Data Visualization

サービス

• Writing
• Research
• Consulting
• Data & AI

Writing Technical Writing, Creative Writing, General Proofreading & Editing

Research Fact Checking, Scientific and Technical Research

Consulting Scientific and Technical Consulting

Data & AI Data Visualization

職務経験

Postdoctoral fellowship

University of Antwerp

11月 2020 - 11月 2024

Postdoctoral Researcher

University of Antwerp

5月 2020 - 10月 2020

PhD candidate

University of Antwerp

1月 2017 - 5月 2020

Research Assistant

University of Maragheh

2月 2016 - 8月 2016

Laboratory Instructor chemistry

Tehran Valiasr Girl's Technical University

2月 2013 - 8月 2016

学歴

FWO-Postdoc fellowship (Chemistry)

University of Antwerp

11月 2020 - 現在

PhD researcher (Chemistry, PLASMANT group)

University of Antwerp

1月 2017 - 5月 2020

Master of Science (Chemsitry)

University of Maragheh

9月 2013 - 2月 2016

Master of Science (Chemistry)

Islamic Azad University Tehran North Branch

9月 2008 - 2月 2011

Bachelor (Chemistry)

Islamic Azad University Tehran North Branch

9月 2001 - 7月 2005

認定資格

• Young Scholarship Award

  ELSEVIER

  8月 2019 - 現在

出版物

JOURNAL ARTICLE

Parisa Nematollahi, Umedjon Khalilov, Utkir Uljayev, Kamoliddin Mehmonov, Maksudbek Yusupov, Erik Neyts (2024). Can endohedral transition metals enhance hydrogen storage in carbon nanotubes? . International Journal of Hydrogen Energy.

Parisa Nematollahi, Erik Neyts (2024). Enhancement of Mn-N-C single atom catalysts via sulfur and/or oxygen co-doping for oxygen reduction in acidic conditions: Unveiling the catalyst durability in fuel cells . Molecular Catalysis.

Parisa Nematollahi(2023). Selectivity of Mo N C sites for electrocatalytic N2 reduction: A function of the single atom position on the surface and local carbon topologies . Applied Surface Science. 612. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 155908. Elsevier {BV}

Parisa Nematollahi(2023). Selectivity of Mo N C sites for electrocatalytic N2 reduction: A function of the single atom position on the surface and local carbon topologies . Applied Surface Science. 612. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 155908. Elsevier {BV}

Parisa Nematollahi, Erik Neyts(2022). Identification of a Unique Pyridinic FeN₄C_<i>x</i> Electrocatalyst for N₂ Reduction: Tailoring the Coordination and Carbon Topologies . The Journal of Physical Chemistry C. 126. (34). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 14460--14469. American Chemical Society ({ACS})

Parisa Nematollahi and Bernardo Barbiellini and Arun Bansil and Dirk Lamoen and Jia Qingying and Sanjeev Mukerjee and Erik C. Neyts(2022). Identification of a Robust and Durable FeN₄C_<i>x</i> Catalyst for ORR in PEM Fuel Cells and the Role of the Fifth Ligand . ACS Catalysis. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 7541--7549. American Chemical Society ({ACS})

Parisa Nematollahi and Erik C. Neyts(2022). Distribution Pattern of Metal Atoms in Bimetal-Doped Pyridinic–N₄ Pores Determines Their Potential for Electrocatalytic N₂ Reduction . The Journal of Physical Chemistry A. 126. (20). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 3080--3089. American Chemical Society ({ACS})

Parisa Nematollahi and Hanyu Ma and William F. Schneider and Erik C. Neyts(2021). DFT and Microkinetic Comparison of Ru-Doped Porphyrin-like Graphene and Nanotubes toward Catalytic Formic Acid Decomposition and Formation . The Journal of Physical Chemistry C. 125. (34). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 18673--18683. American Chemical Society ({ACS})

Parisa Nematollahi, Erik C. Neyts (2021). Linking Bi-Metal Distribution Patterns in Porous Carbon Nitride Fullerene to Its Catalytic Activity toward Gas Adsorption . Nanomaterials.

(2020). Direct oxidation of methane to methanol on Co embedded N-doped graphene: Comparing the role of N2O and O2 as oxidants . Applied Catalysis A: General.

(2019). Direct methane conversion to methanol on M and MN4 embedded graphene (M = Ni and Si): A comparative DFT study . Applied Surface Science.

Nematollahi, P., Neyts, E.C.(2018). A comparative DFT study on CO oxidation reaction over Si-doped BC<inf>2</inf>N nanosheet and nanotube . Applied Surface Science. 439. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 934-945.

Nematollahi, P., Esrafili, M.D., Neyts, E.C.(2018). The role of healed N-vacancy defective BC<inf>2</inf>N sheet and nanotube by NO molecule in oxidation of NO and CO gas molecules . Surface Science. 672-673. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 39-46.

Esrafili, M.D., Nematollahi, P.(2017). Potential of Si-doped boron nitride nanotubes as a highly active and metal-free electrocatalyst for oxygen reduction reaction: A DFT study . Synthetic Metals. 226. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 129-138.

Vessally, E., Esrafili, M.D., Nurazar, R., Nematollahi, P., Bekhradnia, A.(2017). A DFT study on electronic and optical properties of aspirin-functionalized B<inf>12</inf>N<inf>12</inf> fullerene-like nanocluster . Structural Chemistry. 28. (3). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 735-748.

Esrafili, M.D., Nematollahi, P., Nurazar, R.(2016). Pd-embedded graphene: An efficient and highly active catalyst for oxidation of CO . Superlattices and Microstructures. 92. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 60-67.

Esrafili, M.D., Saeidi, N., Nematollahi, P.(2016). A DFT study on SO<inf>3</inf>capture and activation over Si- or Al-doped graphene . Chemical Physics Letters. 658. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 146-151.

Nematollahi, P., Esrafili, M.D.(2016). A DFT study on the N<inf>2</inf>O reduction by CO molecule over silicon carbide nanotubes and nanosheets . RSC Advances. 6. (64). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 59091-59099.

Esrafili, M.D., Nematollahi, P., Abdollahpour, H.(2016). A comparative DFT study on the CO oxidation reaction over Al- and Ge-embedded graphene as efficient metal-free catalysts . Applied Surface Science. 378. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 418-425.

Esrafili, M.D., Nematollahi, P., Nurazar, R.(2016). A comparative study of the CO oxidation reaction over pristine and C-doped boron nitride fullerene . RSC Advances. 6. (21). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 17172-17178.

Esrafili, M.D., Sharifi, F., Nematollahi, P.(2016). A comparative theoretical study of CO oxidation reaction by O<inf>2</inf>molecule over Al- or Si-decorated graphene oxide . Journal of Molecular Graphics and Modelling. 69. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 8-16.

Esrafili, M.D., Nematollahi, P., Nurazar, R.(2016). A density functional theory study on adsorption and decomposition of acetic acid over silicon carbide nanotubes . Synthetic Metals. 215. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 164-169.

Esrafili, M.D., Sharifi, F., Nematollahi, P.(2016). Al- or Si-decorated graphene oxide: A favorable metal-free catalyst for the N<inf>2</inf>O reduction . Applied Surface Science. 387. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 454-460.

Esrafili, M.D., Nurazar, R., Nematollahi, P.(2016). Ambient carbon dioxide capture by different dimensional AlN nanostructures: A comparative DFT study . Superlattices and Microstructures. 96. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 164-173.

Nematollahi, P., Esrafili, M.D.(2016). Catalytic activity of silicon carbide nanotubes and nanosheets for oxidation of CO: A DFT study . New Journal of Chemistry. 40. (3). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 2775-2784.

Esrafili, M.D., Mohammadian-Sabet, F., Nematollahi, P.(2016). Catalytic decomposition of hydrazine borane over pristine and Al-embedded boron nitride nanotubes: A DFT study . International Journal of Hydrogen Energy. 41. (44). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 20172-20184.

Mahmoudi, G., Afkhami, F.A., Jena, H.S., Nematollahi, P., Esrafili, M.D., Garczarek, P., Van Hecke, K., Servati Gargari, M., Kirillov, A.M.(2016). Halide ion-driven self-assembly of Zn(ii) compounds derived from an asymmetrical hydrazone building block: a combined experimental and theoretical study . New Journal of Chemistry. 40. (12). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 10116-10126.

Esrafili, M.D., Mohammadian-Sabet, F., Nematollahi, P.(2016). Oxidation of CO by N<inf>2</inf>O over Al- and Ti-doped graphene: A comparative study . RSC Advances. 6. (69). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 64832-64840.

Esrafili, M.D., Saeidi, N., Nematollahi, P.(2016). Si-doped graphene: A promising metal-free catalyst for oxidation of SO<inf>2</inf> . Chemical Physics Letters. 649. Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 37-43.

Esrafili, M.D., Saeidi, N., Nematollahi, P.(2016). The healing of B- or N-vacancy defective BNNTs by using CO molecule: A DFT study . New Journal of Chemistry. 40. (9). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 8024-8031.

Esrafili, M.D., Mohammad-Valipour, R., Mousavi-Khoshdel, S.M., Nematollahi, P.(2015). A Comparative Study of CO Oxidation on Nitrogen- and Phosphorus-Doped Graphene . ChemPhysChem. 16. (17). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 3719-3727.

Esrafili, M.D., Nematollahi, P.(2015). A computational investigation of oxygen reduction reaction mechanisms on Si- and Al-doped graphene: A comparative study . Advanced Materials Letters. 6. (6). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 527-530.

Esrafili, M.D., Saeidi, N., Nematollahi, P.(2015). Can Si-embedded boron nitride nanotubes act as a favorable metal-free catalyst for CO oxidation by N<inf>2</inf>O? . RSC Advances. 5. (121). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 100290-100298.

Nematollahi, P., Esrafili, M.D., Bagheri, A.(2015). Functionalization of single-walled (n,0) carbon and boron nitride nanotubes by carbonyl derivatives (n = 5, 6): a DFT study . Canadian Journal of Chemistry. 94. (1). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 105-111.

Esrafili, M.D., Ghanbari, M., Nurazar, R., Nematollahi, P.(2015). Theoretical study of formamide decomposition pathways over (6,0) silicon-carbide nanotube . Journal of Molecular Modeling. 21. (4). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 1-8.