A DFT study on the sensing behavior of a BC2N nanotube toward formaldehyde
Published 2013 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
A DFT study on the sensing behavior of a BC2N nanotube toward formaldehyde
Authors
Keywords
Band gap, B3LYP, DFT, Nanostructures, Sensor
Journal
JOURNAL OF MOLECULAR MODELING
Volume 19, Issue 9, Pages 3843-3850
Publisher
Springer Nature
Online
2013-06-25
DOI
10.1007/s00894-013-1922-9
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Effects of Al Doping and Double-Antisite Defect on the Adsorption of HCN on a BC2N Nanotube: Density Functional Theory Studies
- (2013) Ali Ahmadi Peyghan et al. Journal of Physical Chemistry C
- Selective adsorption behavior of BC2N nanotubes toward fluoride and chloride
- (2013) Mohammad T. Baei et al. SOLID STATE COMMUNICATIONS
- Hydrogen dissociation on diene-functionalized carbon nanotubes
- (2012) Javad Beheshtian et al. JOURNAL OF MOLECULAR MODELING
- Nitrate adsorption by carbon nanotubes in the vacuum and aqueous phase
- (2012) Javad Beheshtian et al. MONATSHEFTE FUR CHEMIE
- A first-principles study of H2S adsorption and dissociation on the AlN nanotube
- (2012) Javad Beheshtian et al. PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES
- Detection of phosgene by Sc-doped BN nanotubes: A DFT study
- (2012) Javad Beheshtian et al. SENSORS AND ACTUATORS B-CHEMICAL
- The H2 dissociation on the BN, AlN, BP and AlP nanotubes: a comparative study
- (2011) Javad Beheshtian et al. JOURNAL OF MOLECULAR MODELING
- A comparative study on the B12N12, Al12N12, B12P12 and Al12P12 fullerene-like cages
- (2011) Javad Beheshtian et al. JOURNAL OF MOLECULAR MODELING
- Silicon Carbide Nanotubes Serving as a Highly Sensitive Gas Chemical Sensor for Formaldehyde
- (2011) Xiao Wang et al. Journal of Physical Chemistry C
- Carbon nanotubes combined with inorganic nanomaterials: Preparations and applications
- (2010) Haibin Chu et al. COORDINATION CHEMISTRY REVIEWS
- Reactivities of Sites on (5,5) Single-Walled Carbon Nanotubes with and without a Stone-Wales Defect
- (2010) T. C. Dinadayalane et al. Journal of Chemical Theory and Computation
- Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
- (2009) Jiayu Dai et al. APPLIED PHYSICS LETTERS
- Adsorption of carbon dioxide and methane on graphene with a high titanium coverage
- (2009) I. Carrillo et al. CARBON
- Ionic liquids for synthesis of inorganic nanomaterials
- (2009) Zhonghao Li et al. CURRENT OPINION IN SOLID STATE & MATERIALS SCIENCE
- Raman and infrared-active modes in MgO nanotubes
- (2009) Liang Chen et al. PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES
- Adsorption of pairs of NOx molecules on single-walled carbon nanotubes and formation of NO+NO3 from NO2
- (2009) Jiayu Dai et al. SURFACE SCIENCE
- Adsorption of formaldehyde molecule on the pristine and silicon-doped boron nitride nanotubes
- (2008) Ruoxi Wang et al. CHEMICAL PHYSICS LETTERS
- Adsorption ofH2O,NH3, CO,NO2, and NO on graphene: A first-principles study
- (2008) O. Leenaerts et al. PHYSICAL REVIEW B
- Synthesis, structure and properties of homogeneous BC4N nanotubes
- (2007) Kalyan Raidongia et al. JOURNAL OF MATERIALS CHEMISTRY
- Molecular Doping of Graphene
- (2007) T. O. Wehling et al. NANO LETTERS
Add your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload NowCreate your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create Now