volume 35 issue 8 pages 1519-1528

Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers

Lisbeth Ahjopalo 1
Barbro Löfgren 2
Kimmo Hakala 2
Lars-Olof Pietilä 1
Publication typeJournal Article
Publication date1999-08-01
scimago Q1
wos Q1
SJR1.076
CiteScore10.2
Impact factor6.3
ISSN00143057, 18731945
Materials Chemistry
Organic Chemistry
General Physics and Astronomy
Polymers and Plastics
Abstract
Metallocene catalyzed copolymerization of ethylene with comonomers having polar functional groups (alcohols, carboxylic acids and esters) has been studied experimentally and by molecular modeling. The polar functional groups strongly reduce the activity of the catalyst. The deactivation of the catalyst is investigated with DFT calculations on some model systems. The effect of the spacer length between the double bond and the functional group is analyzed using molecular dynamics and molecular mechanics methods, and compared with experiments.
Found 
Found 

Top-30

Journals

1
2
Journal of Polymer Science, Part A: Polymer Chemistry
2 publications, 9.09%
Progress in Polymer Science
1 publication, 4.55%
Polymer
1 publication, 4.55%
International Polymer Science and Technology
1 publication, 4.55%
Reactive and Functional Polymers
1 publication, 4.55%
European Polymer Journal
1 publication, 4.55%
Applied Catalysis A: General
1 publication, 4.55%
European Journal of Inorganic Chemistry
1 publication, 4.55%
Angewandte Chemie
1 publication, 4.55%
Angewandte Chemie - International Edition
1 publication, 4.55%
Journal of Applied Polymer Science
1 publication, 4.55%
Macromolecular Rapid Communications
1 publication, 4.55%
Macromolecules
1 publication, 4.55%
Macromolecular Reaction Engineering
1 publication, 4.55%
Dalton Transactions
1 publication, 4.55%
Advances in Polymer Science
1 publication, 4.55%
Catalysts
1 publication, 4.55%
Petroleum Chemistry
1 publication, 4.55%
Russian Chemical Reviews
1 publication, 4.55%
1
2

Publishers

1
2
3
4
5
6
7
8
Wiley
8 publications, 36.36%
Elsevier
7 publications, 31.82%
SAGE
1 publication, 4.55%
American Chemical Society (ACS)
1 publication, 4.55%
Royal Society of Chemistry (RSC)
1 publication, 4.55%
Springer Nature
1 publication, 4.55%
MDPI
1 publication, 4.55%
Pleiades Publishing
1 publication, 4.55%
Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
1 publication, 4.55%
1
2
3
4
5
6
7
8
  • We do not take into account publications without a DOI.
  • Statistics recalculated weekly.

Are you a researcher?

Create a profile to get free access to personal recommendations for colleagues and new articles.
Metrics
22
Share
Cite this
GOST |
Cite this
GOST Copy
Ahjopalo L. et al. Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers // European Polymer Journal. 1999. Vol. 35. No. 8. pp. 1519-1528.
GOST all authors (up to 50) Copy
Ahjopalo L., Löfgren B., Hakala K., Pietilä L. Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers // European Polymer Journal. 1999. Vol. 35. No. 8. pp. 1519-1528.
RIS |
Cite this
RIS Copy
TY - JOUR
DO - 10.1016/s0014-3057(98)00233-x
UR - https://doi.org/10.1016/s0014-3057(98)00233-x
TI - Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers
T2 - European Polymer Journal
AU - Ahjopalo, Lisbeth
AU - Löfgren, Barbro
AU - Hakala, Kimmo
AU - Pietilä, Lars-Olof
PY - 1999
DA - 1999/08/01
PB - Elsevier
SP - 1519-1528
IS - 8
VL - 35
SN - 0014-3057
SN - 1873-1945
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{1999_Ahjopalo,
author = {Lisbeth Ahjopalo and Barbro Löfgren and Kimmo Hakala and Lars-Olof Pietilä},
title = {Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers},
journal = {European Polymer Journal},
year = {1999},
volume = {35},
publisher = {Elsevier},
month = {aug},
url = {https://doi.org/10.1016/s0014-3057(98)00233-x},
number = {8},
pages = {1519--1528},
doi = {10.1016/s0014-3057(98)00233-x}
}
MLA
Cite this
MLA Copy
Ahjopalo, Lisbeth, et al. “Molecular modeling of metallocene catalyzed copolymerization of ethylene with functional comonomers.” European Polymer Journal, vol. 35, no. 8, Aug. 1999, pp. 1519-1528. https://doi.org/10.1016/s0014-3057(98)00233-x.