effective pair potential
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2020 ◽  
Vol 28 (7) ◽  
pp. 075006 ◽  
Author(s):  
R Gröger ◽  
V Vitek ◽  
A Dlouhý




2019 ◽  
Vol 123 (21) ◽  
pp. 4594-4603 ◽  
Author(s):  
Chong-Li Zhao ◽  
Dong-Xia Zhao ◽  
Cui-Cui Bei ◽  
Xiang-Na Meng ◽  
Shenmin Li ◽  
...  


2017 ◽  
Vol 19 (6) ◽  
pp. 4787-4792 ◽  
Author(s):  
Guillaume Bareigts ◽  
Christophe Labbez

We proposed a simple and versatile method to calculate the effective pair potential between charged colloids which can easily be used in popular molecular simulation program packages and extended to non-spherical particles.



2016 ◽  
Vol 93 (3) ◽  
Author(s):  
Su-Hyun Yoo ◽  
Ji-Hwan Lee ◽  
Young-Kwang Jung ◽  
Aloysius Soon


2014 ◽  
Vol 118 (41) ◽  
pp. 12034-12049 ◽  
Author(s):  
Alexander E. Kobryn ◽  
Dragan Nikolić ◽  
Olga Lyubimova ◽  
Sergey Gusarov ◽  
Andriy Kovalenko






2013 ◽  
Vol 371 ◽  
pp. 373-377 ◽  
Author(s):  
Nikolai Dubinin

An influence of the degree of account of the non-diagonal couplings between d electrons sited on different atoms in a transition metal on the main characteristics of the first minimums of the Wills-Harrison (WH) effective pair potentials in liquid Fe, Co and Ni are investigated. It is found that at full aforementioned account the WH potential is transformed to the simple-metal-pseudopotential-theory effective pair potential and that first-minimum positions of WH potentials abruptly shift to right side at predominance of the non-diagonal d-d-couplings in a metal.



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