Three-dimensional inverse design of nanopatterns with block copolymers and homopolymers

Nanoscale ◽  
2016 ◽  
Vol 8 (9) ◽  
pp. 5235-5244 ◽  
Author(s):  
Dan Xu ◽  
Hong Liu ◽  
You-Liang Zhu ◽  
Zhong-Yuan Lu
Keyword(s):  
Block Copolymers ◽  
Dissipative Particle Dynamics ◽  
Three Dimensional ◽  
Design Strategy ◽  
Particle Dynamics ◽  
Inverse Design ◽  
Dynamics Simulations

We propose a facile inverse design strategy to generate 3D nanopatterns by using either block copolymers or a binary homopolymer blendviadissipative particle dynamics simulations.

Self-assembly of block copolymers on lithographically patterned template with ordered posts

2015 ◽  
Vol 17 (47) ◽  
pp. 31830-31838 ◽  
Author(s):  
Dan Xu ◽  
Hong Liu ◽  
Yao-Hong Xue ◽  
Yan-Bo Sun
Keyword(s):  
Block Copolymers ◽  
Self Assembly ◽  
Dissipative Particle Dynamics ◽  
Particle Dynamics ◽  
The Self ◽  
Dynamics Simulations

Dissipative particle dynamics simulations are employed to study the self-assembly of block copolymers on a template modified with ordered posts.

Polymer-mediated nanorod self-assembly predicted by dissipative particle dynamics simulations

Soft Matter ◽  
2015 ◽  
Vol 11 (34) ◽  
pp. 6881-6892 ◽  
Author(s):  
Shaghayegh Khani ◽  
Safa Jamali ◽  
Arman Boromand ◽  
Michael J. A. Hore ◽  
Joao Maia
Keyword(s):  
Phase Diagram ◽  
Polymer Matrix ◽  
Self Assembly ◽  
Dissipative Particle Dynamics ◽  
Three Dimensional ◽  
Particle Dynamics ◽  
Nano Rods ◽  
Dynamics Simulations

Three dimensional phase diagram for controlled aggregation/dispersion of polymer grafted nano-rods in a polymer matrix.

Nonequilibrium Simulations of Lamellae Forming Block Copolymers under Steady Shear: A Comparison of Dissipative Particle Dynamics and Brownian Dynamics

2012 ◽  
Vol 45 (19) ◽  
pp. 8109-8116 ◽  
Author(s):  
Brandon L. Peters ◽  
Abelardo Ramírez-Hernández ◽  
Darin Q. Pike ◽  
Marcus Müller ◽  
Juan J. de Pablo
Keyword(s):  
Block Copolymers ◽  
Brownian Dynamics ◽  
Dissipative Particle Dynamics ◽  
Particle Dynamics ◽  
Steady Shear

Coarse-Graining of Chain Models in Dissipative Particle Dynamics Simulations†

2011 ◽  
Vol 50 (1) ◽  
pp. 69-77 ◽  
Author(s):  
Justin R. Spaeth ◽  
Todd Dale ◽  
Ioannis G. Kevrekidis ◽  
Athanassios Z. Panagiotopoulos
Keyword(s):  
Dissipative Particle Dynamics ◽  
Coarse Graining ◽  
Particle Dynamics ◽  
Dynamics Simulations

A dissipative particle dynamics simulation study on phase diagrams for the self-assembly of amphiphilic hyperbranched multiarm copolymers in various solvents

Soft Matter ◽  
2017 ◽  
Vol 13 (36) ◽  
pp. 6178-6188 ◽  
Author(s):  
Haina Tan ◽  
Chunyang Yu ◽  
Zhongyuan Lu ◽  
Yongfeng Zhou ◽  
Deyue Yan
Keyword(s):  
Phase Diagrams ◽  
Simulation Study ◽  
Self Assembly ◽  
Dissipative Particle Dynamics ◽  
Particle Dynamics ◽  
The Self ◽  
Dynamics Simulation ◽  
Dynamics Simulations ◽  
First Time ◽  
Dissipative Particle Dynamics Simulation

This work discloses for the first time the self-assembly phase diagrams of amphiphilic hyperbranched multiarm copolymers in various solvents by dissipative particle dynamics simulations.

scholarly journals Correction: Dissipative particle dynamics and molecular dynamics simulations on mesoscale structure and proton conduction in a SPEEK/PVDF-g-PSSA membrane

RSC Advances ◽  
2017 ◽  
Vol 7 (66) ◽  
pp. 41787-41787
Author(s):  
Yue Ma ◽  
Yuxiang Wang ◽  
Xuejian Deng ◽  
Guanggang Zhou ◽  
Shah Khalid ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Dissipative Particle Dynamics ◽  
Particle Dynamics ◽  
Proton Conduction ◽  
Mesoscale Structure ◽  
Dynamics Simulations

Correction for ‘Dissipative particle dynamics and molecular dynamics simulations on mesoscale structure and proton conduction in a SPEEK/PVDF-g-PSSA membrane’ by Yue Ma et al., RSC Adv., 2017, 7, 39676–39684.

scholarly journals Dissipative particle dynamics and molecular dynamics simulations on mesoscale structure and proton conduction in a SPEEK/PVDF-g-PSSA membrane

RSC Advances ◽  
2017 ◽  
Vol 7 (63) ◽  
pp. 39676-39684 ◽  
Author(s):  
Yue Ma ◽  
Yuxiang Wang ◽  
Xuejian Deng ◽  
Guanggang Zhou ◽  
Sha Khalid ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Dissipative Particle Dynamics ◽  
Particle Dynamics ◽  
Proton Conduction ◽  
Small Particles ◽  
Cluster Network ◽  
Mesoscale Structure ◽  
Dynamics Simulations

The blend morphologies evolve from disordered small particles to a regular PVDF cluster network, which were connected by SPEEK cylindrical channels.

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