The Ge-doped (6,0) zigzag single-walled boron phosphide nanotubes: A computational study

Mohammad T. Baei; Masoumeh Moghimi; Parviz Torabi; Ali Varasteh Moradi

doi:10.1016/j.comptc.2011.06.005

The Ge-doped (6,0) zigzag single-walled boron phosphide nanotubes: A computational study

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2011.06.005 ◽

2011 ◽

Vol 972 (1-3) ◽

pp. 14-19 ◽

Cited By ~ 12

Author(s):

Mohammad T. Baei ◽

Masoumeh Moghimi ◽

Parviz Torabi ◽

Ali Varasteh Moradi

Keyword(s):

Computational Study ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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Carbon doped boron phosphide nanotubes: A computational study

Journal of Molecular Modeling ◽

10.1007/s00894-010-0702-z ◽

2010 ◽

Vol 17 (1) ◽

pp. 89-96 ◽

Cited By ~ 17

Author(s):

Mahmoud Mirzaei

Keyword(s):

Computational Study ◽

Carbon Doped ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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Theoretical Study of Phenol Adsorption on Pristine, Ga-Doped, and Pd-Decorated (6,0) Zigzag Single-Walled Boron Phosphide Nanotubes

Journal of Cluster Science ◽

10.1007/s10876-012-0513-8 ◽

2012 ◽

Vol 24 (1) ◽

pp. 49-60 ◽

Cited By ~ 13

Author(s):

Ali Ahmadi Peyghan ◽

Mohammad T. Baei ◽

Masoumeh Moghimi ◽

Saeedeh Hashemian

Keyword(s):

Theoretical Study ◽

Phenol Adsorption ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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Computational studies of effects of tubular lengths on the NMR properties of pristine and carbon decorated boron phosphide nanotubes

Solid State Sciences ◽

10.1016/j.solidstatesciences.2011.08.018 ◽

2011 ◽

Vol 13 (11) ◽

pp. 1926-1930 ◽

Cited By ~ 8

Author(s):

Mahmoud Mirzaei ◽

Masoumeh Meskinfam

Keyword(s):

Computational Studies ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes ◽

Nmr Properties

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NMR parameters of SiC-doped (6,0) zigzag single-walled boron phosphide nanotubes: a density functional study

Monatshefte für Chemie - Chemical Monthly ◽

10.1007/s00706-011-0498-2 ◽

2011 ◽

Vol 142 (8) ◽

pp. 783-788 ◽

Cited By ~ 10

Author(s):

Mohammad T. Baei ◽

Parviz Torabi ◽

Ali Varasteh Moradi ◽

Masoumeh Moghimi

Keyword(s):

Density Functional ◽

Functional Study ◽

Density Functional Study ◽

Nmr Parameters ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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NMR and NQR parameters of Si-doped (6,0) zigzag single-walled boron phosphide nanotubes: a density functional study

Monatshefte für Chemie - Chemical Monthly ◽

10.1007/s00706-011-0547-x ◽

2011 ◽

Vol 142 (11) ◽

pp. 1097-1104 ◽

Cited By ~ 12

Author(s):

Mohammad T. Baei ◽

Ali Varasteh Moradi ◽

Parviz Torabi ◽

Masoumeh Moghimi

Keyword(s):

Density Functional ◽

Functional Study ◽

Density Functional Study ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes ◽

Si Doped ◽

Nqr Parameters

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Carbon-Doped (6,0) Single-Walled Boron-Phosphide Nanotubes: A DFT Investigation of Electronic Structure, Surface Electrostatic Potential and QTAIM Analysis

Fullerenes Nanotubes and Carbon Nanostructures ◽

10.1080/1536383x.2013.771170 ◽

2014 ◽

Vol 23 (2) ◽

pp. 142-147

Author(s):

Mehdi D. Esrafili

Keyword(s):

Electronic Structure ◽

Electrostatic Potential ◽

Qtaim Analysis ◽

Carbon Doped ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes ◽

Structure Surface ◽

Surface Electrostatic Potential

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Covalent Functionalization of Pristine and Ga-Doped Boron Phosphide Nanotubes with Imidazole

Phosphorus Sulfur and Silicon and the Related Elements ◽

10.1080/10426507.2013.829827 ◽

2014 ◽

Vol 189 (4) ◽

pp. 453-464 ◽

Cited By ~ 4

Author(s):

S. Zahra Sayyad-Alangi ◽

Saeedeh Hashemian ◽

Mohammad T. Baei

Keyword(s):

Covalent Functionalization ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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The effect of doping three Al and N atoms on the chemical shielding tensor parameters of the boron phosphide nanotubes: A DFT study

Physica B Condensed Matter ◽

10.1016/j.physb.2011.09.020 ◽

2012 ◽

Vol 407 (1) ◽

pp. 22-26 ◽

Cited By ~ 6

Author(s):

Mahdi Rezaei-Sameti

Keyword(s):

Dft Study ◽

Chemical Shielding ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes ◽

Shielding Tensor ◽

Effect Of Doping

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Interaction between F2 gas with the pristine and 3C-doped(4, 4) armchair boron phosphide nanotubes: a DFT study

Iranian Journal of Physics Research ◽

10.18869/acadpub.ijpr.15.3.344 ◽

2015 ◽

Vol 15 (3) ◽

pp. 344-344

Author(s):

M Rezaei-Sameti ◽

E A Dadfar ◽

◽

Keyword(s):

Dft Study ◽

Boron Phosphide ◽

Boron Phosphide Nanotubes

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Effects of influence of carbon ring-doping on NMR parameters of boron phosphide nanotubes: A DFT study

Arabian Journal of Chemistry ◽

10.1016/j.arabjc.2010.10.035 ◽

2015 ◽

Vol 8 (2) ◽

pp. 168-173 ◽

Cited By ~ 2

Author(s):

M. Rezaei-Sameti

Keyword(s):

Dft Study ◽

Nmr Parameters ◽

Boron Phosphide ◽

Carbon Ring ◽

Boron Phosphide Nanotubes

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