DFT study of electronic and structural properties of single‐walled gallium nitride nanotubes
M Shabani, T Movlarooy… - International Journal of …, 2023 - Wiley Online Library
The electronic and structural properties of the armchair and zigzag single‐walled GaN
nanotubes (GaNNTs) are studied by using density functional theory. The effects of tube …
nanotubes (GaNNTs) are studied by using density functional theory. The effects of tube …
NH3 and NO2 adsorption analysis of GaN nanotube: A First principle investigation
MS Khan, A Srivastava - Journal of Electroanalytical Chemistry, 2016 - Elsevier
Theoretical investigations using density functional theory have been carried out to examine
the interactions between armchair 4, 4 gallium nitride nanotube (GaNNT) with NH 3 (NO 2) …
the interactions between armchair 4, 4 gallium nitride nanotube (GaNNT) with NH 3 (NO 2) …
[HTML][HTML] Electronic structure of GaN nanotubes
JM Sodré, E Longo, CA Taft… - Comptes …, 2017 - comptes-rendus.academie-sciences …
Résumé Nanotube properties are strongly dependent on their structures. In this study,
gallium nitride nanotubes (GaNNTs) are analyzed in armchair and zigzag conformations …
gallium nitride nanotubes (GaNNTs) are analyzed in armchair and zigzag conformations …
Exploring optical properties of Gd doped zincblende GaN for novel optoelectronic applications (A DFT+ U study)
In current research, we investigate optical properties of Gd doped zincblende GaN using
Wien2K code, by employing DFT+ U. We consider pure GaN and we dope various Gd …
Wien2K code, by employing DFT+ U. We consider pure GaN and we dope various Gd …
Density functional characterization of electronic and optical properties of strontium titanate under doping and strain for optoelectronic applications
We perform first-principles calculations, to investigate the effect of doping of metal dopants
(silver, gold, aluminum, and copper) on the electronic, structural, and optical properties of …
(silver, gold, aluminum, and copper) on the electronic, structural, and optical properties of …
The electronic and optical properties of silicon doped on arsenic and antimony nanotubes: a first-principles study
Y Liu, Z Hu, X Shao - New Journal of Chemistry, 2023 - pubs.rsc.org
Arsenic and antimony nanotubes (As/Sb-NTs) have attracted attention because of their
properties. To improve the photoelectric properties of single-walled arsenic and antimony …
properties. To improve the photoelectric properties of single-walled arsenic and antimony …
Comparative Study on the Structural and Electric Properties of Pristine and Transition Metals (V, Nb, Ta) Doped Gallium Nitride Nanotube: A DFT Investigation
In recent times, researchers have shown high interest in Gallium Nitride nanotubes due to
their remarkable characteristics owing to their reduced dimension and quantum size …
their remarkable characteristics owing to their reduced dimension and quantum size …
Computational study of Cr substituted single-walled GaN nanotubes
US Sharma, R Shah - Journal of Physics: Conference Series, 2017 - iopscience.iop.org
In present study, we have investigated electronic, optical and transport properties of Cr
substituted SW GaNNT. We find that the (6, 0) nanotubes of GaN are stable and …
substituted SW GaNNT. We find that the (6, 0) nanotubes of GaN are stable and …