A review of multiscale computational methods in polymeric materials
A Gooneie, S Schuschnigg, C Holzer - Polymers, 2017 - mdpi.com
Polymeric materials display distinguished characteristics which stem from the interplay of
phenomena at various length and time scales. Further development of polymer systems …
phenomena at various length and time scales. Further development of polymer systems …
Self-assembly of perovskite nanocrystals: from driving forces to applications
Y Li, F Zhang - Journal of Energy Chemistry, 2024 - Elsevier
Self-assembly of metal halide perovskite nanocrystals (NCs) into superlattices can exhibit
unique collective properties, which have significant application values in the display …
unique collective properties, which have significant application values in the display …
An elementary singularity-free rotational brownian dynamics algorithm for anisotropic particles
Brownian Dynamics is the designated technique to simulate the collective dynamics of
colloidal particles suspended in a solution, eg, the self-assembly of patchy particles …
colloidal particles suspended in a solution, eg, the self-assembly of patchy particles …
Computational modeling of passive transport of functionalized nanoparticles
Functionalized nanoparticles (NPs) are complex objects present in a variety of systems
ranging from synthetic grafted nanoparticles to viruses. The morphology and number of the …
ranging from synthetic grafted nanoparticles to viruses. The morphology and number of the …
The design of highly conductive and stretchable polymer conductors with low-load nanoparticles
YT Sun, C Zhao, YL Zhu, JL Guan, LL Zhang, L Wei… - Soft Matter, 2023 - pubs.rsc.org
Highly conductive and stretchable polymer conductors fabricated from conductive fillers and
stretchable polymers are urgently needed in flexible electronics, implants, soft robotics, etc …
stretchable polymers are urgently needed in flexible electronics, implants, soft robotics, etc …
Brownian cluster dynamics with short range patchy interactions: Its application to polymers and step-growth polymerization
We present a novel simulation technique derived from Brownian cluster dynamics used so
far to study the isotropic colloidal aggregation. It now implements the classical Kern-Frenkel …
far to study the isotropic colloidal aggregation. It now implements the classical Kern-Frenkel …
Self-assembly of kagome lattices, entangled webs and linear fibers with vibrating patchy particles in two dimensions
A vibrating version of patchy particles in two dimensions is introduced to study self-assembly
of kagome lattices, disordered networks of loo** structures, and linear arrays …
of kagome lattices, disordered networks of loo** structures, and linear arrays …
A computer simulation study of the hierarchical assembly behaviour of triblock patchy particles
YC Li, NB Zhang, Z Wei, BY Li, MT Li, Y Li - Molecular Simulation, 2019 - Taylor & Francis
We study the hierarchical self-assembly behaviour of ACB triblock patchy particles via
Brownian dynamics (BD) simulations, where the product of the first stage is set as the initial …
Brownian dynamics (BD) simulations, where the product of the first stage is set as the initial …
[PDF][PDF] 金纳米粒子和聚合物复合体系分子设计与组装过程的计算机模拟
**延春, **洋 - 化学进展, 2015 - manu56.magtech.com.cn
金纳米粒子除了拥有纳米粒子的体积效应, 表面效应, 量子尺寸效应, 宏观量子隧道效应等优异
性能之外, 还有一些特殊性能, 如良好的稳定性, 抗菌抑菌功能, 表面吸收带效应, 荧光效应等 …
性能之外, 还有一些特殊性能, 如良好的稳定性, 抗菌抑菌功能, 表面吸收带效应, 荧光效应等 …