Density functional study on the regioselectivity of styrene polymerization with an awsa-metallocene catalyst

Physics & Astronomy

• styrenes 100%
• insertion 85%
• polymerization 82%
• catalysts 81%
• products 9%
• propagation 8%
• phenyls 8%
• monomers 6%
• polystyrene 6%
• density functional theory 5%
• rings 5%
• interactions 2%

Chemical Compounds

• Regioselectivity 83%
• Styrene 70%
• Density Functional Theory 54%
• Polymerization Reaction 52%
• Catalyst 36%
• Block Like Crystal 13%
• Metallocene 8%
• Force 6%
• Monomer 5%