Adsorption properties of SCN− on (6,0), (7,0), (8,0), and Al-doped (6,0) zigzag single-walled carbon nanotubes: a density functional study

Adsorption Properties ◽

Functional Study ◽

Single Walled Carbon ◽

Adsorption properties of OCN radical on (6,0), (8,0), and (10,0) zigzag single-walled carbon nanotubes: a density functional study

Monatshefte für Chemie - Chemical Monthly ◽

10.1007/s00706-010-0415-0 ◽

2010 ◽

Vol 142 (1) ◽

pp. 1-4 ◽

Cited By ~ 19

Author(s):

Mohammad T. Baei ◽

S. Zahra Sayyed-Alangi ◽

Alireza Soltani ◽

Mahsa Bahari ◽

Anis Masoodi

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Adsorption Properties ◽

Functional Study ◽

Single Walled Carbon ◽

Adsorption properties of N2O on (6,0), (7,0), (8,0), and Al-doped (6,0) zigzag single-walled carbon nanotubes: a density functional study

Monatshefte für Chemie - Chemical Monthly ◽

10.1007/s00706-011-0484-8 ◽

2011 ◽

Vol 142 (6) ◽

pp. 573-578 ◽

Cited By ~ 14

Author(s):

Mohammad T. Baei ◽

Ali Reza Soltani ◽

Ali Varasteh Moradi ◽

Masoumeh Moghimi

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Adsorption Properties ◽

Functional Study ◽

Single Walled Carbon ◽

Adsorption properties of CH3COOH on (6,0), (7,0), and (8,0) zigzag, and (4,4), and (5,5) armchair single-walled carbon nanotubes: A density functional study

Arabian Journal of Chemistry ◽

10.1016/j.arabjc.2013.11.039 ◽

2017 ◽

Vol 10 ◽

pp. S3001-S3006 ◽

Cited By ~ 5

Author(s):

Maziar Noei ◽

Ali-Akbar Salari ◽

Mahsa Madani ◽

Mina Paeinshahri ◽

Hossein Anaraki-Ardakani

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Adsorption Properties ◽

Functional Study ◽

Single Walled Carbon ◽

A Density Functional Study on Transition-Metal-Coated Single-Walled Carbon Nanotubes

The Journal of Physical Chemistry C ◽

10.1021/jp7108253 ◽

2008 ◽

Vol 112 (25) ◽

pp. 9128-9132 ◽

Cited By ~ 15

Author(s):

Guo Wang ◽

Yuanhe Huang

Keyword(s):

Carbon Nanotubes ◽

Transition Metal ◽

Density Functional ◽

Functional Study ◽

Single Walled Carbon ◽

Density functional study of Al/N co-doped (10,0) zigzag single-walled carbon nanotubes as CO sensor

Computational Materials Science ◽

10.1016/j.commatsci.2013.10.021 ◽

2014 ◽

Vol 82 ◽

pp. 497-502 ◽

Cited By ~ 17

Author(s):

Masood Hamadanian ◽

Forough Kalantari Fotooh

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Functional Study ◽

Single Walled Carbon ◽

Co Sensor ◽

Walled Carbon Nanotubes ◽

Co Doped

2014 IEEE 41st International Conference on Plasma Sciences (ICOPS) held with 2014 IEEE International Conference on High-Power Particle Beams (BEAMS) ◽

Field emission current from single walled carbon nanotubes with adsorbates and defects for several chiralities: A density functional study

10.1109/plasma.2014.7012562 ◽

2014 ◽

Author(s):

Timothy P. Fleming

Keyword(s):

Carbon Nanotubes ◽

Field Emission ◽

Density Functional ◽

Emission Current ◽

Functional Study ◽

Single Walled Carbon ◽

Field Emission Current ◽

Stacking- and chirality-dependent collapse of single-walled carbon nanotubes: A large-scale density-functional study

Physical Review B ◽

10.1103/physrevb.100.115410 ◽

2019 ◽

Vol 100 (11) ◽

Cited By ~ 3

Author(s):

A. Impellizzeri ◽

P. Briddon ◽

C. P. Ewels

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Large Scale ◽

Functional Study ◽

Single Walled Carbon ◽

Density Functional Study of the13C NMR Chemical Shifts in Small-to-Medium-Diameter Infinite Single-Walled Carbon Nanotubes

The Journal of Physical Chemistry A ◽

10.1021/jp064540f ◽

2006 ◽

Vol 110 (43) ◽

pp. 11995-12004 ◽

Cited By ~ 57

Author(s):

Eva Zurek ◽

Chris J. Pickard ◽

Brian Walczak ◽

Jochen Autschbach

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Chemical Shifts ◽

Functional Study ◽

Nmr Chemical Shifts ◽

Single Walled Carbon ◽

Walled Carbon Nanotubes ◽

Medium Diameter

Screened exchange hybrid density-functional study of the work function of pristine and doped single-walled carbon nanotubes

The Journal of Chemical Physics ◽

10.1063/1.2150213 ◽

2006 ◽

Vol 124 (2) ◽

pp. 024709 ◽

Cited By ~ 72

Author(s):

Verónica Barone ◽

Juan E. Peralta ◽

Jamal Uddin ◽

Gustavo E. Scuseria

Keyword(s):

Carbon Nanotubes ◽

Work Function ◽

Density Functional ◽

Functional Study ◽

Single Walled Carbon ◽

Screened Exchange ◽

Walled Carbon Nanotubes ◽

Hybrid Density Functional

Density Functional Study of the13C NMR Chemical Shifts in Single-Walled Carbon Nanotubes with Stone−Wales Defects

The Journal of Physical Chemistry C ◽

10.1021/jp803180v ◽

2008 ◽

Vol 112 (31) ◽

pp. 11744-11750 ◽

Cited By ~ 40

Author(s):

Eva Zurek ◽

Chris J. Pickard ◽

Jochen Autschbach

Keyword(s):

Carbon Nanotubes ◽

Density Functional ◽

Chemical Shifts ◽

Functional Study ◽

Nmr Chemical Shifts ◽

Single Walled Carbon ◽