Adsorption sensitivity of pristine and Al- or Si-doped boron nitride nanoflake to COCl2: a DFT study-Reference-Cited by-同舟云学术

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Adsorption sensitivity of pristine and Al- or Si-doped boron nitride nanoflake to COCl2: a DFT study

Published:2018-10-18 Issue:5 Volume:117 Page:626-634
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Moladoust Roghayeh¹,Esrafili Mehdi D.²^ORCID,Hosseinian Akram³,Alkorta Ibon⁴^ORCID,Vessally Esmail⁵

Affiliation:

1. Department of Chemistry, Faculty of Basic Sciences, University of Mohaghegh Ardabili, Ardabil, Iran

2. Laboratory of Theoretical Chemistry, Department of Chemistry, University of Maragheh, Maragheh, Iran

3. School of Engineering Science, College of Engineering, University of Tehran, Tehran, Iran

4. Instituto de Quimica Medica (CSIC), Juan de la Cierva, Madrid, Spain

5. Department of Chemistry, Payame Noor University, Tehran, Iran

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2018.1532538

Reference80 articles.

1. Occupational phosgene poisoning: a case report and review.

2. Skeletal Muscle

3. Chemisorption of NO2 on Carbon Nanotubes

4. Density functional theory study of atomic oxygen, O2 and O3 adsorptions on the H-capped (5,0) single-walled carbon nanotube

5. Similarities and differences in O2 chemisorption on graphene nanoribbon vs. carbon nanotube

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3. The adsorption of CO and CO2 gases on (6,4) and (7,7) AlN nanotubes for enhanced sensor applications: A DFT approach;Results in Chemistry;2024-07

4. Adsorption Behavior of Hfco and Cof2 Gases on Pristine, Al-Doped, and N-Doped (8, 0) Single-Wall Carbon Nanotubes and Pristine Aluminum Nitride Nanotube: A First-Principles Study;2024

5. Understanding the adsorption behavior of C2H3Cl on pristine, Al-, and Ga-doped boron nitride nanosheets;Computational and Theoretical Chemistry;2023-11

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