scholarly journals Symmetry and structure of carbon-nitrogen complexes in gallium arsenide from infrared spectroscopy and first-principles calculations

2018 ◽  
Vol 123 (16) ◽  
pp. 161553
Author(s):  
Christopher Künneth ◽  
Simon Kölbl ◽  
Hans Edwin Wagner ◽  
Volker Häublein ◽  
Alfred Kersch ◽  
...  
Keyword(s):  
Gallium Arsenide ◽  
Infrared Spectroscopy ◽  
First Principles ◽  
First Principles Calculations

Orbital change manipulation metal–insulator transition temperature in W-doped VO2

2015 ◽  
Vol 17 (17) ◽  
pp. 11638-11646 ◽  
Author(s):  
Xinfeng He ◽  
Yijie Zeng ◽  
Xiaofeng Xu ◽  
Congcong Gu ◽  
Fei Chen ◽  
...  
Keyword(s):  
Phase Transition ◽  
Infrared Spectroscopy ◽  
Transition Temperature ◽  
Phase Transition Temperature ◽  
First Principles ◽  
Insulator Transition ◽  
First Principles Calculations ◽  
Orbital Structure ◽  
Metal Insulator Transition ◽  
Metal Insulator

Using ultraviolet-infrared spectroscopy and first principles calculations, it is revealed that changes in the orbital structure can regulate the W-doped VO2 phase transition temperature.

scholarly journals Adsorption mechanisms of fatty acids on fluorite unraveled by infrared spectroscopy and first-principles calculations

2021 ◽  
Vol 583 ◽  
pp. 692-703 ◽  
Author(s):  
Yann Foucaud ◽  
Juliette Lainé ◽  
Lev O. Filippov ◽  
Odile Barrès ◽  
Won June Kim ◽  
...  
Keyword(s):  
Fatty Acids ◽  
Infrared Spectroscopy ◽  
First Principles ◽  
First Principles Calculations ◽  
Adsorption Mechanisms

Pressure tuning of the thermal conductivity of gallium arsenide from first-principles calculations

2018 ◽  
Vol 20 (48) ◽  
pp. 30331-30339 ◽  
Author(s):  
Zhehao Sun ◽  
Kunpeng Yuan ◽  
Xiaoliang Zhang ◽  
Dawei Tang
Keyword(s):  
Thermal Conductivity ◽  
Gallium Arsenide ◽  
Transport Properties ◽  
First Principles ◽  
Thermal Transport ◽  
First Principles Calculations ◽  
Pressure Tuning ◽  
Thermal Transport Properties

Pressure tuning of the thermal transport properties of gallium arsenide.

Vibrational and Thermal Properties of Ag3[Co(CN)6] from First-Principles Calculations and Infrared Spectroscopy

2013 ◽  
Vol 117 (24) ◽  
pp. 12848-12857 ◽  
Author(s):  
P. Hermet ◽  
J. Catafesta ◽  
J.-L. Bantignies ◽  
C. Levelut ◽  
D. Maurin ◽  
...  
Keyword(s):  
Thermal Properties ◽  
Infrared Spectroscopy ◽  
First Principles ◽  
First Principles Calculations

scholarly journals Methanol Desorption from Cu-ZSM-5 Studied by In Situ Infrared Spectroscopy and First-Principles Calculations

2017 ◽  
Vol 121 (49) ◽  
pp. 27389-27398 ◽  
Author(s):  
Xueting Wang ◽  
Adam A. Arvidsson ◽  
Magdalena O. Cichocka ◽  
Xiaodong Zou ◽  
Natalia M. Martin ◽  
...  
Keyword(s):  
Infrared Spectroscopy ◽  
First Principles ◽  
First Principles Calculations ◽  
In Situ Infrared Spectroscopy

scholarly journals Gallium arsenide thermal conductivity and optical phonon relaxation times from first-principles calculations

2013 ◽  
Vol 101 (1) ◽  
pp. 16001 ◽  
Author(s):  
Tengfei Luo ◽  
Jivtesh Garg ◽  
Junichiro Shiomi ◽  
Keivan Esfarjani ◽  
Gang Chen
Keyword(s):  
Thermal Conductivity ◽  
Gallium Arsenide ◽  
Optical Phonon ◽  
First Principles ◽  
Relaxation Times ◽  
First Principles Calculations
Sign in / Sign up

Export Citation Format

Share Document