Structural, electronic and mechanical properties of single-walled AlN and GaN nanotubes via DFT/B3LYP

Porous silicene and silicon graphenylene-like surfaces: a DFT study

(2018) G. S. L. Fabris et al.   THEORETICAL CHEMISTRY ACCOUNTS

Large-Scale Condensed Matter DFT Simulations: Performance and Capabilities of the CRYSTAL Code

(2017) A. Erba et al.   Journal of Chemical Theory and Computation

Structural, Electronic, Vibrational, and Topological Analysis of Single-Walled Zinc Oxide Nanotubes

(2016) Naiara L. Marana et al.   Journal of Physical Chemistry C

Periodic density functional theory study of structural and electronic properties of single-walled zinc oxide and carbon nanotubes

(2016) Naiara L. Marana et al.   JOURNAL OF SOLID STATE CHEMISTRY

Hirshfeld-I charges in linear combination of atomic orbitals periodic calculations

(2016) C. M. Zicovich-Wilson et al.   THEORETICAL CHEMISTRY ACCOUNTS

Nanoscale conductive pattern of the homoepitaxial AlGaN/GaN transistor

(2015) A Pérez-Tomás et al.   NANOTECHNOLOGY

Electronic structure and magnetic properties of substitutional transition-metal atoms in GaN nanotubes

(2014) Min Zhang et al.   Chinese Physics B

DFT study of the dissociative adsorption of HF on an AlN nanotube

(2013) Maziar Noei et al.   COMPTES RENDUS CHIMIE

Single-crystalline GaN nanotube arrays grown on c-Al2O3 substrates using InN nanorods as templates

(2013) Huijie Li et al.   JOURNAL OF CRYSTAL GROWTH

Can aluminum nitride nanotubes detect the toxic NH3 molecules?

(2012) Ali Ahmadi Peyghan et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Fluorination of the exterior surface of AlN nanotube: A DFT study

(2012) Mohammad T. Baei et al.   SUPERLATTICES AND MICROSTRUCTURES

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

A density functional theory study of CO2 and N2 adsorption on aluminium nitride single walled nanotubes

(2010) Yan Jiao et al.   JOURNAL OF MATERIALS CHEMISTRY

AlN synthesis on AlN/SiC template using Li-Al-N solvent

(2010) Yoshihiro Kangawa et al.   PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE

High-excitation and high-resolution photoluminescence spectra of bulk AlN

(2010) Martin Feneberg et al.   PHYSICAL REVIEW B

Efeitos da adição de átomos de Mn na rede do GaN via métodos de estrutura eletrônica

(2010) Melânia Cristina Mazini et al.   QUIMICA NOVA