scholarly journals First-principles study of hydrogen-bonded molecular conductorκ−H3(Cat−EDT−TTF/ST)2

2015 ◽  
Vol 92 (3) ◽  
Author(s):  
Takao Tsumuraya ◽  
Hitoshi Seo ◽  
Reizo Kato ◽  
Tsuyoshi Miyazaki
Keyword(s):  
First Principles ◽  
First Principles Study ◽  
Hydrogen Bonded

First principles study of isotope effect in hydrogen-bonded K3H(SO4)2: I — stable structures

2001 ◽  
Vol 79 (1) ◽  
pp. 31-44 ◽  
Author(s):  
Yuji Suwa ◽  
Jun Yamauchi ◽  
Hiroyuki Kageshima ◽  
Shinji Tsuneyuki
Keyword(s):  
Isotope Effect ◽  
First Principles ◽  
First Principles Study ◽  
Stable Structures ◽  
Hydrogen Bonded

First principles study of photostability within hydrogen-bonded amino acids

2011 ◽  
Vol 13 (17) ◽  
pp. 7805 ◽  
Author(s):  
Marco Marazzi ◽  
Unai Sancho ◽  
Obis Castaño ◽  
Luis Manuel Frutos
Keyword(s):  
Amino Acids ◽  
First Principles ◽  
First Principles Study ◽  
Hydrogen Bonded

First principles study of isotope effect in hydrogen-bonded K3H(SO4):

2001 ◽  
Vol 79 (2) ◽  
pp. 98-112 ◽  
Author(s):  
Yuji Suwa ◽  
Jun Yamauchi ◽  
Hiroyuki Kageshima ◽  
Shinji Tsuneyuki
Keyword(s):  
Isotope Effect ◽  
First Principles ◽  
First Principles Study ◽  
Hydrogen Bonded

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.

Sign in / Sign up

Export Citation Format

Share Document