Ab initio study of NH3 and H2O adsorption on pristine and Na-doped MgO nanotubes

Comprehensive Study on the Dissociative Chemisorption of NH3 on the Sidewalls of Stone–Wales Defective Armchair (5,5) Single-Walled Carbon Nanotubes

(2012) M. A. Turabekova et al.   Journal of Physical Chemistry C

Benchmarking of ONIOM method for the study of NH3 dissociation at open ends of BNNTs

(2011) Ali Ahmadi et al.   JOURNAL OF MOLECULAR MODELING

Computational study of CO and NO adsorption on magnesium oxide nanotubes

(2011) Javad Beheshtian et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Interaction of NH3 with aluminum nitride nanotube: Electrostatic vs. covalent

(2011) Ali Ahmadi et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Theoretical study of aluminum nitride nanotubes for chemical sensing of formaldehyde

(2011) Ali Ahmadi et al.   SENSORS AND ACTUATORS B-CHEMICAL

A theoretical study of CO adsorption on aluminum nitride nanotubes

(2011) Javad Beheshtian et al.   STRUCTURAL CHEMISTRY

Exploring the structural and electronic properties of nitrogen-containing exohydrogenated carbon nanotubes: a quantum chemistry study

(2010) M. Leonor Contreras et al.   STRUCTURAL CHEMISTRY

Chemisorption of NH3 at the open ends of boron nitride nanotubes: a DFT study

(2010) Ali Ahmadi et al.   STRUCTURAL CHEMISTRY

Remarkable diversity of carbon–carbon bonds: structures and properties of fullerenes, carbon nanotubes, and graphene

(2010) T. C. Dinadayalane et al.   STRUCTURAL CHEMISTRY

Thickness-dependent electronic and optical properties of faceted hexagonal aluminum nitride nanotubes

(2008) Karim Rezouali et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES