First Principles Molecular Dynamics Study of Ziegler−Natta Heterogeneous Catalysis-Reference-Cited by-同舟云学术

First Principles Molecular Dynamics Study of Ziegler−Natta Heterogeneous Catalysis

Published:1998-03-17 Issue:12 Volume:120 Page:2746-2752
ISSN:0002-7863
Container-title:Journal of the American Chemical Society
language:en
Short-container-title:J. Am. Chem. Soc.

Author:

Boero Mauro¹,Parrinello Michele¹,Terakura Kiyoyuki¹

Affiliation:

1. Contribution from the Max Planck Institut für Festkörperforschung, Heisenbergstrasse 1, D-70569 Stuttgart, Germany, and Joint Research Center for Atom Technology (JRCAT), National Institute for Advanced Interdisciplinary Research (NAIR), 1-1-4 Higashi, Tsukuba, Ibaraki 305, Japan

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

Link

https://pubs.acs.org/doi/pdf/10.1021/ja972367i

Reference61 articles.

1. Das Mülheimer Normaldruck-Polyäthylen-Verfahren

Cited by 222 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Exploring Ti active sites in Ziegler-Natta catalysts through realistic-scale computer simulations with universal neural network potential;Molecular Catalysis;2024-08

2. Influence of titanium loading of TiCl4/MgCl2 Ziegler-Natta catalyst on Trans-1,4 polymerization of isoprene;Polymer;2024-07

3. The Role of External Donors in Ziegler–Natta Catalysts through Nudged Elastic Band Simulations on Realistic-Scale Models Employing a Universal Neural Network Potential;The Journal of Physical Chemistry C;2024-04-12

4. Active sparse Bayesian committee machine potential for isothermal–isobaric molecular dynamics simulations;Physical Chemistry Chemical Physics;2024

5. Exploring Ti Active Sites in Ziegler-Natta Catalysts Through Realistic-Scale Computer Simulations with Universal Neural Network Potential;2024