First-principles study of oxidized BC2N nanotubes

2012 ◽  
Vol 112 (20) ◽  
pp. 3312-3319 ◽  
Author(s):  
Caroline Jaskulski Rupp ◽  
Jussane Rossato ◽  
Rogério José Baierle
Keyword(s):  
First Principles ◽  
First Principles Study ◽  
Bc2n Nanotubes

First principles study of Si-doped BC2N nanotubes

2009 ◽  
Vol 130 (11) ◽  
pp. 114710 ◽  
Author(s):  
C. J. Rupp ◽  
J. Rossato ◽  
R. J. Baierle
Keyword(s):  
First Principles ◽  
First Principles Study ◽  
Si Doped ◽  
Bc2n Nanotubes

Strain tuned high thermal conductivity in boron phosphide at nanometer length scales – a first-principles study

2020 ◽  
Vol 22 (36) ◽  
pp. 20914-20921 ◽  
Author(s):  
Rajmohan Muthaiah ◽  
Jivtesh Garg
Keyword(s):  
Thermal Conductivity ◽  
First Principles ◽  
High Thermal Conductivity ◽  
Biaxial Strain ◽  
Length Scales ◽  
First Principles Study ◽  
Boron Phosphide

We report novel pathways to significantly enhance the thermal conductivity at nanometer length scales in boron phosphide through biaxial strain.

First-principles study of two-dimensional bilayer GaN: structure, electronic properties and temperature effect

2019 ◽  
Vol 58 (SC) ◽  
pp. SCCB35 ◽  
Author(s):  
Tomoe Yayama ◽  
Anh Khoa Augustin Lu ◽  
Tetsuya Morishita ◽  
Takeshi Nakanishi
Keyword(s):  
Temperature Effect ◽  
Electronic Properties ◽  
First Principles ◽  
Two Dimensional ◽  
First Principles Study
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