Atomistic Structures, Stabilities, Electronic Properties, and Chemical Bonding of Boron–Aluminum Mixed Clusters B3Al0/−/+n (n = 2–6)

Author(s):  
Limei Wen ◽  
Dan Zhou ◽  
Li-Ming Yang ◽  
Guoliang Li ◽  
Eric Ganz
2018 ◽  
Vol 6 (7) ◽  
pp. 1651-1658 ◽  
Author(s):  
Dong Fan ◽  
Shaohua Lu ◽  
Yundong Guo ◽  
Xiaojun Hu

We identify two B–C bonding patterns: pyramidal-geometry tetra-coordinated and hexa-coordinated sp2carbon moiety; B4C3has an ultrahigh Young's modulus that can even outperform graphene; the B2C sheet is metallic with a relatively high superconducting transition temperature (Tc≈ 21.20 K).


2015 ◽  
Vol 17 (25) ◽  
pp. 16545-16552 ◽  
Author(s):  
Yu-Tsung Lin ◽  
Hsien-Ching Chung ◽  
Po-Hua Yang ◽  
Shih-Yang Lin ◽  
Ming-Fa Lin

The geometric and electronic properties of passivated armchair graphene nanoribbons, enriched by strong chemical bonding between edge-carbons and various adatoms, are investigated by first-principle calculations.


1999 ◽  
Vol 85 (2) ◽  
pp. 969-977 ◽  
Author(s):  
Jingxi Sun ◽  
Dong Ju Seo ◽  
W. L. O’Brien ◽  
F. J. Himpsel ◽  
A. B. Ellis ◽  
...  

1990 ◽  
Vol 87 (2) ◽  
pp. 366-377 ◽  
Author(s):  
J. Olivier-Fourcade ◽  
A. Ibanez ◽  
J.C. Jumas ◽  
M. Maurin ◽  
I. Lefebvre ◽  
...  

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