Ab initio spin-dependent band structures of carbon nanotubes

International Journal of Quantum Chemistry ◽

10.1002/qua.25030 ◽

2015 ◽

Vol 116 (4) ◽

pp. 316-324 ◽

Author(s):

Pavel D'yachkov ◽

Dmitry Makaev

Keyword(s):

Carbon Nanotubes ◽

Ab Initio ◽

Band Structures

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Electronic band structures of NdFe3(BO3)4 and NdGa3(BO3)4 crystals: ab initio calculations

Ferroelectrics ◽

10.1080/00150193.2021.1888219 ◽

2021 ◽

Vol 575 (1) ◽

pp. 11-17

Author(s):

S. Krylova ◽

I. Gudim ◽

A. Aleksandrovsky ◽

A. Vtyurin ◽

A. Krylov

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Band Structures ◽

Electronic Band ◽

Electronic Band Structures

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Ab Initio Modeling of the Mechanical Properties of Carbon Nanotubes Using Gaussian

52nd AIAA/ASME/ASCE/AHS/ASC Structures, Structural Dynamics and Materials Conference ◽

10.2514/6.2011-1919 ◽

2011 ◽

Author(s):

Joe Hoffman

Keyword(s):

Mechanical Properties ◽

Carbon Nanotubes ◽

Ab Initio ◽

Ab Initio Modeling

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Ab Initio Study of Topological Defects in Single Walled Carbon Nanotubes and their Effect on Gas Sensing Mechanism

10.1063/1.3587023 ◽

2011 ◽

Author(s):

Aarti Srirangarajan ◽

Mousumi Upadhyay Kahaly ◽

Abdul Manaf Hashim ◽

Vijay K. Arora

Keyword(s):

Carbon Nanotubes ◽

Ab Initio ◽

Gas Sensing ◽

Topological Defects ◽

Single Walled Carbon Nanotubes ◽

Ab Initio Study ◽

Single Walled Carbon ◽

Sensing Mechanism ◽

Walled Carbon Nanotubes

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Theoretical investigation of quasiparticle band structures and optical spectra of large-diameter semiconducting single-walled carbon nanotubes

The 8th Annual IEEE International Conference on Nano/Micro Engineered and Molecular Systems ◽

10.1109/nems.2013.6559683 ◽

2013 ◽

Author(s):

Y. Y. Xia ◽

J. L. Mu ◽

X. Leng ◽

Y. C. Ma ◽

M. W. Zhao ◽

...

Keyword(s):

Carbon Nanotubes ◽

Theoretical Investigation ◽

Large Diameter ◽

Single Walled Carbon Nanotubes ◽

Optical Spectra ◽

Band Structures ◽

Single Walled Carbon ◽

Walled Carbon Nanotubes ◽

Quasiparticle Band

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Ab initio study of semiconducting carbon nanotubes adsorbed on the Si(100) surface: Diameter- and registration-dependent atomic configurations and electronic properties

Journal of Applied Physics ◽

10.1063/1.2400404 ◽

2006 ◽

Vol 100 (12) ◽

pp. 124304 ◽

Author(s):

Salvador Barraza-Lopez ◽

Peter M Albrecht ◽

Nichols A. Romero ◽

Karl Hess

Keyword(s):

Carbon Nanotubes ◽

Ab Initio ◽

Electronic Properties ◽

Ab Initio Study ◽

Surface Diameter

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Experimental determination of excitonic band structures of single-walled carbon nanotubes using circular dichroism spectra

Nature Communications ◽

10.1038/ncomms12899 ◽

2016 ◽

Vol 7 (1) ◽

Author(s):

Xiaojun Wei ◽

Takeshi Tanaka ◽

Yohei Yomogida ◽

Naomichi Sato ◽

Riichiro Saito ◽

...

Keyword(s):

Carbon Nanotubes ◽

Experimental Determination ◽

Single Walled Carbon Nanotubes ◽

Circular Dichroism Spectra ◽

Band Structures ◽

Single Walled Carbon ◽

Excitonic Band ◽

Walled Carbon Nanotubes ◽

Circular Dichroïsm

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Adsorption of isoniazid and pyrazinamide drug molecules onto nitrogen-doped single-wall carbon nanotubes: an ab initio study

Structural Chemistry ◽

10.1007/s11224-013-0327-9 ◽

2013 ◽

Vol 25 (2) ◽

pp. 593-605 ◽

Author(s):

Nabanita Saikia ◽

Ramesh C. Deka

Keyword(s):

Carbon Nanotubes ◽

Ab Initio ◽

Single Wall Carbon Nanotubes ◽

Ab Initio Study ◽

Single Wall Carbon ◽

Nitrogen Doped ◽

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Strain-rate and temperature dependent plastic yield in carbon nanotubes from ab initio calculations

Applied Physics Letters ◽

10.1063/1.1695630 ◽

2004 ◽

Vol 84 (15) ◽

pp. 2775-2777 ◽

Author(s):

Traian Dumitrică ◽

Boris I. Yakobson

Keyword(s):

Carbon Nanotubes ◽

Ab Initio Calculations ◽

Strain Rate ◽

Ab Initio ◽

Temperature Dependent ◽

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Ab initio study of semiconductor atoms impurities in zigzag edge (10,0) carbon nanotubes

10.1063/1.4917137 ◽

2015 ◽

Author(s):

Fahdzi Muttaqien ◽

Suprijadi

Keyword(s):

Carbon Nanotubes ◽

Ab Initio ◽

Ab Initio Study ◽

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Band structures of double-walled carbon nanotubes

Journal of Vacuum Science & Technology B Microelectronics and Nanometer Structures Processing Measurement and Phenomena ◽

10.1116/1.2188409 ◽

2006 ◽

Vol 24 (3) ◽

pp. 1098 ◽

Author(s):

Y. H. Ho ◽

G. W. Ho ◽

S. J. Wu ◽

M. F. Lin

Keyword(s):

Carbon Nanotubes ◽

Band Structures ◽

Double Walled Carbon Nanotubes ◽

Walled Carbon Nanotubes

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