Pressure-tensor method evaluation of the interfacial tension between Gay-Berne isotropic fluid and a smooth repulsive wall

Soft Matter ◽  
2021 ◽  
Author(s):  
Jagroop Kaur ◽  
Debabrata Deb
Keyword(s):  
Molecular Dynamics ◽  
Liquid Crystalline ◽  
Pairwise Interaction ◽  
Crystalline Material ◽  
Dynamics Simulation ◽  
Pressure Tensor ◽  
Method Evaluation ◽  
Tensor Method ◽  
Ellipsoidal Particles ◽  
Liquid Crystalline Material

The interfacial properties of confined thermotropic liquid crystalline material {\color{red} are} investigated using {\color{red} the} molecular dynamics simulation technique. The pairwise interaction among {\color{red}the} soft ellipsoidal particles is modeled by...

A New Liquid-Crystalline Material. Transition Metal-Poly(yne) Polymers

1979 ◽  
Vol 12 (5) ◽  
pp. 1016-1018 ◽  
Author(s):  
S. Takahashi ◽  
E. Murata ◽  
M. Kariya ◽  
K. Sonogashira ◽  
N. Hagihara
Keyword(s):  
Transition Metal ◽  
Liquid Crystalline ◽  
Crystalline Material ◽  
Liquid Crystalline Material

scholarly journals Molecular dynamics simulation of α-unsubstituted oligo-thiophenes: dependence of their high-temperature liquid-crystalline phase behaviour on molecular length

2019 ◽  
Vol 7 (32) ◽  
pp. 9984-9995 ◽  
Author(s):  
Flora D. Tsourtou ◽  
Stavros D. Peroukidis ◽  
Vlasis G. Mavrantzas
Keyword(s):  
Molecular Dynamics ◽  
Phase Diagram ◽  
High Temperature ◽  
Molecular Dynamics Simulation ◽  
Liquid Crystalline ◽  
Md Simulations ◽  
Phase Behaviour ◽  
Dynamics Simulation ◽  
Molecular Length ◽  
Temperature Liquid

Phase diagram of α-nT oligomers with n = 5–8 from the MD simulations.

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