Výsledky vyhledávání - "Nazanin Molaei"

Akademický článek

Adsorption of Aniline Toxic Gas on a BeO Nanotube

Autor: Sahar Mohajeri, Mina Kamani, Ali Akbar Salari, Maziar Noei, Maryam Ebrahimikia, Nastaran Ahmadaghaei, Nazanin Molaei

Publikováno v: Iranian Journal of Chemistry & Chemical Engineering, Vol 38, Iss 1, Pp 43-48 (2019)

Electrical sensitivity of a beryllium oxide nanotube (BeONT) was examined toward aniline (C6H5 NH2) molecule by using Density Functional Theory (DFT) calculations at the B3LYP/6-31G (d) level, and it was found that the adsorption energy (Ead) of anil

Externí odkaz: https://doaj.org/article/b884758d7ae649ddb53979ea4f5aeee8

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Akademický článek

Adsorption of Phosphine on a BN Nanosurface

Autor: Sahar Mohajeri, Maziar Noei, Ali Akbar Salari, Zeynab Hoseini, Nastaran Ahmadaghaei, Nazanin Molaei

Publikováno v: Iranian Journal of Chemistry & Chemical Engineering, Vol 37, Iss 1, Pp 39-45 (2018)

Electrical sensitivity of a Boron Nitride Nano Sheet (BNNS) to phosphine (PH3) molecule is studied using Density Functional Theory (DFT) calculations at the B3LYP/6-31G(d) level of theory. The adsorption energy (Ead) of phosphine on the surface of th

Externí odkaz: https://doaj.org/article/124bc03217384bebb9a3d23fab363716

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Akademický článek

Cyanogen, Methylacetylene, Hydroquinone, Ethylacetylene, Aniline, Pyrrole, and Ethanol Detection by Using BNNT: DFT Studies

Autor: Sahar Mohajeri, Maziar Noei, Nazanin Molaei

Publikováno v: Iranian Journal of Chemistry & Chemical Engineering, Vol 36, Iss 5, Pp 89-98 (2017)

Electrical sensitivity of a Boron Nitride Nano Tube (BNNT) was examined toward hydroquinone (C6H4(OH)2), cyanogens (C2N2), methylacetylene (C3H4), ethylacetylene (C4H6), aniline (C6H5NH2), ethanol (C2H5OH), pyrrole (C4H5N), molecules by using Density

Externí odkaz: https://doaj.org/article/9b31fdcd5cfe4302bd9d11539d40f37c

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Pyrrole adsorption on aluminum nitride nanotubes on DFT data

Autor: Omid Moradi, Maziar Noei, Maryam Ahadi, Maryam Ebrahimikia, Nazanin Molaei, Ali Akbar Salan

Publikováno v: Russian Journal of Physical Chemistry A. 90:2221-2229

The adsorption behavior of pyrrole molecule with external surface of (5.0) on zigzag aluminum nitride nanotube (AlNNT) was studied using density functional theory calculations. It was found that the adsorption energy (E ad) of pyrrole on the surface

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::4468870f804bd259c6c703580f41dd45
https://doi.org/10.1134/s0036024416110182

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