Alkyl-Based Surfactants at a Liquid Mercury Surface: Computer Simulation of Structure, Self-Assembly, and Phase Behavior

2016 ◽  
Vol 7 (8) ◽  
pp. 1546-1553 ◽  
Author(s):  
Anton Iakovlev ◽  
Dmitry Bedrov ◽  
Marcus Müller
Keyword(s):  
Computer Simulation ◽  
Phase Behavior ◽  
Self Assembly ◽  
Mercury Surface ◽  
Liquid Mercury

A simulation study of self-assembly of ABC star terpolymers confined between two parallel surfaces

Soft Matter ◽  
2021 ◽  
Author(s):  
Zhiyao Liu ◽  
Zheng Wang ◽  
Yuhua Yin ◽  
Run Jiang ◽  
Baohui Li
Keyword(s):  
Simulated Annealing ◽  
Phase Behavior ◽  
Phase Diagrams ◽  
Simulation Study ◽  
Self Assembly ◽  
Simulated Annealing Method ◽  
Parallel Surfaces ◽  
Annealing Method

Phase behavior of ABC star terpolymers confined between two identical parallel surfaces is systematically studied with a simulated annealing method. Several phase diagrams are constructed for systems with different bulk...

scholarly journals Computer simulation of the phase behavior of a model membrane protein: Annexin V

2002 ◽  
Vol 116 (16) ◽  
pp. 7217-7224 ◽  
Author(s):  
Martin A. Bates ◽  
Massimo G. Noro ◽  
Daan Frenkel
Keyword(s):  
Computer Simulation ◽  
Membrane Protein ◽  
Phase Behavior ◽  
Annexin V ◽  
Model Membrane

scholarly journals Adsorption and self-assembly of linear polymers on surfaces: a computer simulation study

Soft Matter ◽  
2009 ◽  
Vol 5 (3) ◽  
pp. 637-645 ◽  
Author(s):  
Alexandros Chremos ◽  
Emmanouil Glynos ◽  
Vasileios Koutsos ◽  
Philip J. Camp
Keyword(s):  
Computer Simulation ◽  
Simulation Study ◽  
Self Assembly ◽  
Linear Polymers ◽  
Computer Simulation Study

scholarly journals Computer simulation of copolymer phase behavior

2002 ◽  
Vol 117 (22) ◽  
pp. 10329-10338 ◽  
Author(s):  
Andrew J. Schultz ◽  
Carol K. Hall ◽  
Jan Genzer
Keyword(s):  
Computer Simulation ◽  
Phase Behavior

Self-assembly and phase behavior of mixed patchy colloids with any bonding site geometry: theory and simulation

Soft Matter ◽  
2020 ◽  
Vol 16 (15) ◽  
pp. 3806-3820 ◽  
Author(s):  
Yiwei Zhu ◽  
Artee Bansal ◽  
Shun Xi ◽  
Jinxin Lu ◽  
Walter G. Chapman
Keyword(s):  
Phase Behavior ◽  
Self Assembly ◽  
Novel Theory ◽  
Patchy Colloids ◽  
Bonding Site

Novel theory incorporating multibody correlations accurately predicts aggregation and phase behavior in mixed Janus, Saturn ring, and Ternary patchy colloids.

Self-assembly of highly asymmetric, poly(ionic liquid)-rich diblock copolymers and the effects of simple structural modification on phase behaviour

2019 ◽  
Vol 10 (6) ◽  
pp. 751-765 ◽  
Author(s):  
Alyssa W. May ◽  
Zhangxing Shi ◽  
Dilanji B. Wijayasekara ◽  
Douglas L. Gin ◽  
Travis S. Bailey
Keyword(s):  
Ionic Liquid ◽  
Phase Behavior ◽  
Self Assembly ◽  
Structural Modification ◽  
Diblock Copolymers ◽  
Alkyl Substituent ◽  
Phase Behaviour ◽  
Phase Boundaries ◽  
Poly Ionic Liquid

A series of ATRP-synthesized poly(IL) diblock copolymers exhibit morphological phase behavior with shifted phase boundaries and alkyl substituent dependent segregation.

Computer Simulation of Self-Assembly of Disc-Shaped Nanoparticles

2013 ◽  
Vol 710 ◽  
pp. 716-719
Author(s):  
Bo Du ◽  
Zi Lu Wang ◽  
Xue Hao He
Keyword(s):  
Computer Simulation ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Simulated Annealing ◽  
Formation Mechanism ◽  
Self Assembly ◽  
Nematic Phase ◽  
The Self ◽  
Isotropic Phase ◽  
Shaped Nanoparticles

Understanding how nanoparticles self-assemble into specific structures is important in biology. The self-assembly structures of disc-shaped nanoparticles are investigated using Gay Berne potential. Through the simulated annealing Monte Carlo simulation underNVTcondition, we found that various nanostructures such as nematic phase and isotropic phase are discovered. The formation mechanism of these novel nanostructures is discussed.

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