The Grüneisen parameter at high pressure: a molecular dynamical study

1985 ◽  
Vol 39 (3) ◽  
pp. 167-177 ◽  
Author(s):  
Mark A. Barton ◽  
Frank D. Stacey
2007 ◽  
Vol 24 (8) ◽  
pp. 2441-2443 ◽  
Author(s):  
Huang Dai-Hui ◽  
Liu Xiu-Ru ◽  
Su Lei ◽  
Hu Yun ◽  
Lv Shi-Jie ◽  
...  

2010 ◽  
Vol 24 (03) ◽  
pp. 331-341
Author(s):  
SHOUXIN CUI ◽  
LINGCANG CAI ◽  
HAIQUAN HU ◽  
ZIZHENG GONG ◽  
JIJUN ZHAO

The improved Tosi–Fumi pair potential has been employed to simulate the melting behavior and Grüneisen parameters of sodium chloride ( NaCl ) using molecular dynamics (MD) method at constant volume. The melting curve of NaCl is compared with the experimental data and other calculations in a pressure range from 0 to 144 GPa. The simulated results validate the amount of 20% superheating of the NaCl solid and yield an approximate power law dependence of the Grüneisen parameter (γ) on compression γ = γ0(V/V0)q, with q ≈ 1.078, in the temperature range from 298 to 1073 K and pressure range from 0 to 60 GPa.


2007 ◽  
Vol 40 (17) ◽  
pp. 5327-5330 ◽  
Author(s):  
D H Huang ◽  
X R Liu ◽  
L Su ◽  
C G Shao ◽  
R Jia ◽  
...  

1988 ◽  
pp. 441-445
Author(s):  
R. Boehler ◽  
A. Skoropanov ◽  
D. O'Mara ◽  
G. C. Kennedy

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