Parvaneh Delir Kheirollahi Nezhad

Payame Noor University — IR

Materials Science · Physical Sciences

16h-index784citations52works0.02yr avg
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Research Topics

Boron and Carbon Nanomaterials Research(14), Graphene research and applications(10), Gas Sensing Nanomaterials and Sensors(8), Crystallization and Solubility Studies(7), X-ray Diffraction in Crystallography(7)

Publications52 total

Retraction notice to “Gallium and scandium doping effect on the sensing performance of aluminum phosphide nanotubes toward toxic ethylene oxide gas” [Physics Letters A Volume 441, 29 July 2022, 128145]
Physics Letters A·2024
Retraction notice to “Investigation of crotonaldehyde adsorption on pure and Pd-decorated GaN nanotubes: A density functional theory study” [Solid State Commun. 348–349, (2022) 114741]
Solid State Communications·2023
AsH3 adsorption on pristine, P-doped and Ga-doped graphynes: a DFT Study
Bulletin of Materials Science·2022· 4 cited
RETRACTED ARTICLE: A density functional theory study of Au-decorated gallium nitride nano-tubes as chemical sensors for the recognition of sulfonamide
Journal of Sulfur Chemistry·2022· 3 cited
RETRACTED: Gallium and scandium doping effect on the sensing performance of aluminum phosphide nanotubes toward toxic ethylene oxide gas
Physics Letters A·2022· 4 cited
A computational study on the Al-doped CuO nanocluster for CO gas sensor applications
Monatshefte für Chemie - Chemical Monthly·2022· 9 cited
RETRACTED: Investigation of crotonaldehyde adsorption on pure and Pd-decorated GaN nanotubes: A density functional theory study
Solid State Communications·2022· 12 cited
ZnO nanotube semiconductor as a chemical sensor for Platinol anti-cancer drug
Applied Physics A·2022· 2 cited
RETRACTED ARTICLE: Ir-decorated gallium nitride nanotubes as a chemical sensor for recognition of mesalamine drug: a DFT study
Molecular Simulation·2022· 97 cited
A theoretical survey on the FCN detection by the intrinsic and Ti-doped boron carbide nanosheet
Computational and Theoretical Chemistry·2021· 2 cited
Computational investigation of sensing properties of Ca-doped zinc oxide nanotube toward formaldehyde
Journal of Molecular Modeling·2021· 8 cited
Computational survey on the Pt-decorated ZnO nanosheet as a chemical sensor for chlorobenzene: Explaining the experimental observations
Journal of Physics and Chemistry of Solids·2021· 3 cited
A DFT studies on a potential anode compound for Li-ion batteries: Hexa-cata-hexabenzocoronene nanographen
SHILAP Revista de lepidopterología·2021· 46 citedOpen Access
Substituent effects of fused Hammick silylenes via density functional theory survey
Journal of Physical Organic Chemistry·2021· 3 cited
A Computational Study on the Some Small Graphene-Like Nanostructures as the Anodes in Na−Ion Batteries
SHILAP Revista de lepidopterología·2021· 47 citedOpen Access
Magnesium and calcium ion batteries based on the hexa-peri-hexabenzocoronene nanographene anode materials
Inorganic Chemistry Communications·2021· 20 cited
Characterization of IR spectroscopy, APT charge, ESP maps, and AIM analysis of C<sub>20</sub> and its C<sub>20‐n</sub>Al<sub>n</sub> heterofullerene analogous (<i>n</i> = 1–5) using DFT
Journal of Physical Organic Chemistry·2021· 15 cited
A computational perspective of novel <i>N</i>‐heterocyclic silylenes using density functional theory
Journal of Physical Organic Chemistry·2021· 1 cited
Kinetic stability and NBO analysis of the C20-nAln nanocages (n = 1–5) using DFT investigation
Journal of Molecular Structure·2021· 10 cited
Hexa-cata-hexabenzocoronene nanographene as a promising anode material for Mg-ion batteries
Journal of Molecular Modeling·2021· 3 cited
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Frequent Co-authors

Akram Hosseinian(17), Sheida Ahmadi(16), Esmail Vessally(14), Aazam Monfared(5), Kamellia Nejati(5), Zahra Rahmani(5), Ardeshir Shokrollahi(5), Farshid Ramezanipour(5), Ali Moghimi(5), Akbar Hassanpour(5), Saeideh Ebrahimiasl(5), Ladan Edjlali(4), Hossein Aghabozorg(4), Maria Jade Catalan Opulencia(4), Yasser Fakri Mustafa(4), Ali Thaeer Hammid(4), Esmail Vessally(3), A.A. Saei(3), Faranak Manteghi(3), Janet Soleimannejad(3)