Author

Rezvan Rahimi

Observed name: Rahimi, Rezvan

Institution: Arak University

Observed institution: Arak University

OpenAlex ID: A5017469485

BC3 graphene-like monolayer as a drug delivery system for nitrosourea anticancer drug: A first-principles perception

2020 · Rezvan Rahimi, Mohammad Solimannejad · Applied Surface Science · 101

Empowering hydrogen storage performance of B4C3 monolayer through decoration with lithium: A DFT study

2022 · Rezvan Rahimi, Mohammad Solimannejad · Surfaces and Interfaces · 84

High-Performance Hydrogen Storage Properties of Li-Decorated B2N2 Nanosheets: A Periodic Density Functional Theory Study

2021 · Rezvan Rahimi, Mohammad Solimannejad · Energy & Fuels · 81

Toxic volatile organic compounds sensing by Al2C monolayer: A first-principles outlook

2020 · Rezvan Rahimi, Mohammad Solimannejad, et al. · Journal of Hazardous Materials · 68

Pristine B3CN4 monolayer for hydrogen storage: A first-principles approach

2020 · Rezvan Rahimi, Mohammad Solimannejad, et al. · Physics Letters A · 67

Periodic DFT insights into hydrogen storage of a B 4 CN 3 nanosheet

2021 · Rezvan Rahimi, Mohammad Solimannejad · New Journal of Chemistry · 62

Hydrogen storage on pristine and Li-decorated BC6N monolayer from first-principles insights

2020 · Rezvan Rahimi, Mohammad Solimannejad · Molecular Physics · 58

B3O3 monolayer with dual application in sensing of COVID-19 biomarkers and drug delivery for treatment purposes: A periodic DFT study

2022 · Rezvan Rahimi, Mohammad Solimannejad · Journal of Molecular Liquids · 53

Sensing ability of 2D Al2C monolayer toward toxic pnictogen hydrides: A first-principles perspective

2021 · Rezvan Rahimi, Mohammad Solimannejad · Sensors and Actuators A Physical · 52

Li‐decorated Al 2 C monolayer as a potential template for hydrogen storage: A first‐principles perspective

2020 · Rezvan Rahimi, Mohammad Solimannejad · International Journal of Quantum Chemistry · 51

First-principles studies on two-dimensional B3O3 adsorbent as a potential drug delivery platform for TEPA anticancer drug

2021 · Rezvan Rahimi, Mohammad Solimannejad, et al. · Journal of Molecular Modeling · 48

First-principles study of superior hydrogen storage performance of Li-decorated Be2N6 monolayer

2020 · Rezvan Rahimi, Mohammad Solimannejad · International Journal of Hydrogen Energy · 48

DFT study of the adsorption properties and sensitivity of a B2N monolayer toward harmful gases

2024 · Rezvan Rahimi, Mohammad Solimannejad, et al. · Scientific Reports · 44

B 3 O 3 monolayer: an emerging 2D material for CO 2 capture

2021 · Rezvan Rahimi, Mohammad Solimannejad · New Journal of Chemistry · 41

Potential application of XC3 (X = B, N) nanosheets in drug delivery of hydroxyurea anticancer drug: a comparative DFT study

2021 · Rezvan Rahimi, Mohammad Solimannejad, et al. · Molecular Physics · 38

First-principles survey on the pristine BC2N monolayer as a promising vehicle for delivery of β-lapachone anticancer drug

2020 · Rezvan Rahimi, Mohammad Solimannejad · Journal of Molecular Liquids · 37

A novel pentagonal BCN monolayer for sensing and drug delivery of nitrosourea and hydroxyurea anticancer drugs: A DFT outlook

2024 · Rezvan Rahimi, Mohammad Solimannejad · Materials Science in Semiconductor Processing · 34

Adsorption of chloroquine and hydroxychloroquine as potential drugs for SARS-CoV-2 infection on BC 3 nanosheets: a DFT study

2021 · Rezvan Rahimi, Mohammad Solimannejad, et al. · New Journal of Chemistry · 34

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

2024 · Sadegh Kaviani, Irina Piyanzina, et al. · Journal of Power Sources · 30

Gas-sensing performance of BC 3 nanotubes for detecting poisonous cyanogen gas: a periodic DFT approach

2021 · Rezvan Rahimi, Mohammad Solimannejad · New Journal of Chemistry · 28

Two-dimensionalcovalent triazine frameworks as superior nanocarriers for the delivery of thioguanine anti-cancer drugs: a periodic DFT study

2022 · Rezvan Rahimi, Mohammad Solimannejad, et al. · New Journal of Chemistry · 27

In silico study of B3O3 nanosheet as a disposable platform for sensing and delivery of carmustine anticancer drug

2023 · Rezvan Rahimi, Mohammad Solimannejad · Journal of Drug Delivery Science and Technology · 26

Sensing response of pentagonal B2C nanosheet towards VOCs: A study combining DFT and molecular dynamics simulations

2023 · Rezvan Rahimi, Mohammad Solimannejad · Chemical Physics · 23

Nonlinear Optical (NLO) Response of Si12C12 Nanocage Decorated with Alkali Metals (M = Li, Na and K): A Theoretical Study

2017 · Mohammad Solimannejad, Rezvan Rahimi, et al. · Journal of Inorganic and Organometallic Polymers and Materials · 23

Exploring the adsorption behavior of O-containing VOCs in human breath on a B 2 N monolayer using DFT simulations

2024 · Rezvan Rahimi, Mohammad Solimannejad · Physical Chemistry Chemical Physics · 21

Works count: 59

Citation count: 1,413

H-index: 23

I10-index: 34