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Jalili, Seifollah, Hosseinzadeh, Elaheh, Schofield, Jeremy (2014) Study of atomic and molecular oxygen chemisorption on BC3 nanotubes with Stone–Wales defects using density functional theory. Chemical Physics, 438. 16-22 doi:10.1016/j.chemphys.2014.04.010

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Reference TypeJournal (article/letter/editorial)
TitleStudy of atomic and molecular oxygen chemisorption on BC3 nanotubes with Stone–Wales defects using density functional theory
JournalChemical Physics
AuthorsJalili, SeifollahAuthor
Hosseinzadeh, ElahehAuthor
Schofield, JeremyAuthor
Year2014 (June)Volume438
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2014.04.010Search in ResearchGate
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Mindat Ref. ID5963710Long-form Identifiermindat:1:5:5963710:7
GUID0
Full ReferenceJalili, Seifollah, Hosseinzadeh, Elaheh, Schofield, Jeremy (2014) Study of atomic and molecular oxygen chemisorption on BC3 nanotubes with Stone–Wales defects using density functional theory. Chemical Physics, 438. 16-22 doi:10.1016/j.chemphys.2014.04.010
Plain TextJalili, Seifollah, Hosseinzadeh, Elaheh, Schofield, Jeremy (2014) Study of atomic and molecular oxygen chemisorption on BC3 nanotubes with Stone–Wales defects using density functional theory. Chemical Physics, 438. 16-22 doi:10.1016/j.chemphys.2014.04.010
In(n.d.) Chemical Physics Vol. 438. Elsevier BV

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Jalili, Seifollah, Akhavan, Mojdeh, Schofield, Jeremy (2013) Study of titanium adsorption on perfect and defected BC3nanotubes using density functional theory. Molecular Physics, 111. 888-895 doi:10.1080/00268976.2012.756126
Jalili, Seifollah, Akhavan, Mojdeh, Schofield, Jeremy (2012) Electronic and Structural Properties of BC3 Nanotubes with Defects. The Journal of Physical Chemistry C, 116 (24). 13225-13230 doi:10.1021/jp303184q
Jalili, Seifollah, Jamali, Maryam, Schofield, Jeremy (2013) Ab initio study of Li adsorption in carbon nanotubes functionalized with amine and carboxyl groups. Chemical Physics, 418. 35-41 doi:10.1016/j.chemphys.2013.04.004
Akhavan, Mojdeh, Jalili, Seifollah, Schofield, Jeremy (2015) Effect of diameter and chirality on the structure and electronic properties of BC2N nanotubes. Chemical Physics, 455. 88-93 doi:10.1016/j.chemphys.2015.04.018
Jalili, Seifollah, Molani, Farzad, Schofield, Jeremy (2014) First principles study on energetic, structural, and electronic properties of defective g-C3N4-zz3 nanotubes. Journal of Theoretical and Computational Chemistry, 13. 1450021pp. doi:10.1142/s0219633614500217
Akdim, Brahim, Kar, Tapas, Duan, Xiaofeng, Pachter, Ruth (2007) Density functional theory calculations of ozone adsorption on sidewall single-wall carbon nanotubes with Stone-Wales defects. Chemical Physics Letters, 445. 281-287 doi:10.1016/j.cplett.2007.08.001
Jalili, Seifollah, Akhavan, Mojdeh, Schofield, Jeremy (2016) Effect of point defects on the properties of silicene-like BSi3 sheets from first-principles. Journal of Physics and Chemistry of Solids, 95. 106-113 doi:10.1016/j.jpcs.2016.04.004
Jalili, Seifollah, Houshmand, Fatemeh, Schofield, Jeremy (2015) Study of carrier mobility of tubular and planar graphdiyne. Applied Physics A, 119. 571-579 doi:10.1007/s00339-015-8992-8
Peyghan, Ali Ahmadi, Soleymanabadi, Hamed (2014) Adsorption of H2S at Stone–Wales defects of graphene-like BC3: a computational study. Molecular Physics, 112. 2737-2745 doi:10.1080/00268976.2014.909055
Jalili, Seifollah, Molani, Farzad, Schofield, Jeremy (2013) Ti-coated BC2N nanotubes as hydrogen storage materials. Canadian Journal of Chemistry, 91 (7). 598-604 doi:10.1139/cjc-2012-0386
Jalili, Seifollah, Jamali, Maryam (2012) The structural and electronic properties of monovalent sidewall functionalized double-walled carbon nanotubes. Chemical Physics, 402. 91-95 doi:10.1016/j.chemphys.2012.04.016
 
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