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An advanced Monte Carlo simulation algorithm for the fast equilibration of atomistic models ofH-shaped polyethylene melts

机译：一种高级蒙特卡罗仿真算法，用于熔石熔体原子原型的快速平衡

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来源
《AIChE annual meeting》|2003年||共7页
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作者
Nikos Ch. Karayiannis; Vlasis G. Mavrantzas;
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中图分类其他化学工业;
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入库时间 2022-08-20 20:49:31

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专利

1. Advanced Monte Carlo Algorithm for the Atomistic Simulation of Short- and Long-Chain Branched Polymers: Implementation for Model H-Shaped, A3AA3 Multiarm (Pom-Pom), and Short-Chain Branched Polyethylene Melts [J] . Chunggi Baig, Orestis Alexiadis, Vlasis G. Mavrantzas Macromolecules . 2010,第2期

机译：短链和长链支链聚合物原子模拟的高级蒙特卡洛算法：H型模型，A3AA3多臂（Pom-Pom）和短链支链聚乙烯熔体的实现
2. An advanced Monte Carlo method for the equilibrium of model long-chain branched polymers with a well-defined molecular architecture: Detailed atomistic simulation of an H-shaped polyethylene melt [J] . Nikos Ch. Karayiannis, Ageliki E.Giannousaki, Vlasis G.Mavrantzas The Journal of Chemical Physics . 2003,第6期

机译：先进的蒙特卡洛方法，用于平衡具有明确定义的分子结构的模型长链支化聚合物：H形聚乙烯熔体的详细原子模拟
3. An advanced Monte Carlo method for the equilibrium of model long-chain branched polymers with a well-defined molecular architecture: Detailed atomistic simulation of an H-shaped polyethylene melt [J] . Nikos Ch. Karayiannis, Ageliki E.Giannousaki, Vlasis G.Mavrantzas The Journal of Chemical Physics . 2003,第6期

机译：先进的蒙特卡洛方法，用于平衡具有明确定义的分子结构的模型长链支化聚合物：H形聚乙烯熔体的详细原子模拟
4. An advanced Monte Carlo simulation algorithm for the fast equilibration of atomistic models ofH-shaped polyethylene melts [C] . Nikos Ch. Karayiannis, Vlasis G. Mavrantzas AIChE annual meeting . 2003

机译：用于快速平衡H型聚乙烯熔体原子模型的先进Monte Carlo模拟算法
5. Advanced algorithmic techniques for cellular Monte Carlo simulation. [D] . Faralli, Nicolas. 2009

机译：蜂窝蒙特卡洛模拟的先进算法技术。
6. Accelerating molecular Monte Carlo simulations using distance and orientation dependent energy tables: tuning from atomistic accuracy to smoothed coarse-grained models [O] . S. Lettieri, D.M. Zuckerman -1

机译：加速分子monte Carlo模拟使用的距离和方向相关的能量表：调谐从原子论精度平滑粗粒度模型
7. Multiscale Simulations of Graphite-Capped Polyethylene Melts: Brownian Dynamics/Kinetic Monte Carlo Compared to Atomistic Calculations and Experiment [O] . -1

机译：Graphite-Cappe聚乙烯熔体的多尺度模拟：布朗动力学/动力学蒙特卡罗与原子计算和实验相比

An advanced Monte Carlo simulation algorithm for the fast equilibration of atomistic models ofH-shaped polyethylene melts

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