First-principles study of adhesion strength and stability of the TiB2/TiC interface in composite materials

2018 ◽  
Vol 44 (2) ◽  
pp. 1756-1763 ◽  
Author(s):  
Xiaojie Song ◽  
Ye Han ◽  
Xiao Wang ◽  
Weihui Liu ◽  
Jie Wu ◽  
...  
Keyword(s):  
Composite Materials ◽  
Adhesion Strength ◽  
First Principles ◽  
First Principles Study

scholarly journals Effect of van der Waals interactions on the adhesion strength at the interface of the hydroxyapatite–titanium biocomposite: a first-principles study

RSC Advances ◽  
2020 ◽  
Vol 10 (62) ◽  
pp. 37800-37805
Author(s):  
Irina Yu. Grubova ◽  
Maria A. Surmeneva ◽  
Roman A. Surmenev ◽  
Erik C. Neyts
Keyword(s):  
Adhesion Strength ◽  
Significant Role ◽  
First Principles ◽  
Bonding Strength ◽  
Van Der Waals ◽  
Molecular Simulations ◽  
Van Der Waals Interactions ◽  
Hydroxyapatite Coating ◽  
Dispersion Interactions ◽  
First Principles Study

Dispersion interactions play a significant role in altering the bonding strength of the hydroxyapatite coating to the substrate, and such interactions is critical in molecular simulations.

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.

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