Investigation of the interatomic potential using the crystal gamma-ray-induced Doppler-broadening method on oriented Ni single crystals

1999 ◽  
Vol 59 (10) ◽  
pp. 6762-6773 ◽  
Author(s):  
N. Stritt ◽  
J. Jolie ◽  
M. Jentschel ◽  
H. G. Börner ◽  
C. Doll
2021 ◽  
Vol 9 (8) ◽  
pp. 2170030
Author(s):  
Zheng Zhang ◽  
Da Cao ◽  
Zhengjie Huang ◽  
Evgeny O. Danilov ◽  
Ching‐Chang Chung ◽  
...  

Author(s):  
Carlos J. Gomes ◽  
Marcela Madrid ◽  
Cristina H. Amon

We have implemented a parallel molecular dynamics algorithm, which incorporates the Stillinger-Weber interatomic potential. The code was parallelized using a ghost cell atomic division approach, ensuring scaling with the number of processors and a significant increase in speed with respect to the serial version. The methodology is validated by computing the thermal conductivity and phonon frequency spectra of bulk silicon single crystals for different domain sizes at 1000K. The predicted thermal conductivities are consistent with the experimental value at that temperature. In addition, the phonon frequency spectra capture the properties expected from the dispersion relations for silicon.


2015 ◽  
Vol 117 ◽  
pp. 70-77 ◽  
Author(s):  
M. Kalidasan ◽  
K. Asokan ◽  
K. Baskar ◽  
R. Dhanasekaran

2014 ◽  
Vol 118 (6) ◽  
pp. 3244-3250 ◽  
Author(s):  
HyukSu Han ◽  
Minki Hong ◽  
Sasmit S. Gokhale ◽  
Susan B. Sinnott ◽  
Kelly Jordan ◽  
...  

2010 ◽  
Vol 57 (3) ◽  
pp. 1304-1307 ◽  
Author(s):  
Naoto Abe ◽  
Yuui Yokota ◽  
Takayuki Yanagida ◽  
Noriaki Kawaguchi ◽  
Jan Pejchal ◽  
...  
Keyword(s):  

2009 ◽  
Author(s):  
Phillip C. Womble ◽  
Alexander Barzilov ◽  
Ivan Novikov ◽  
Joseph Howard ◽  
Jason Musser ◽  
...  

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