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The mechanism of ethylene with vinyl ether (VE, CH 2 CHOEt) copolymerization catalyzed by phosphine-sulfonate palladium complex ( A ) was investigated by density functional theory (DFT) calculation.

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Mechanistic Studies for Palladium Catalyzed Copolymerization of Ethylene with Vinyl Ethers.

Received: 9 October 2020 Accepted: 16 October 2020 Published: 19 October 2020.

Hydrogen atoms of the catalysts ligand have been omitted for clarity.

All energies are calculated in kcalmol unit and atomic distances are measured in.

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