A study was conducted to demonstrate in situ diversification of (pyridylamide)hafnium(IV) catalysts. An extensive density functional theory (DFT) study was conducted for several C 1-symmetric and C s-symmetric precatalysts to investigate the diversification of the (pyridylamide)hafnium(IV) catalysts. The study also investigated propylene polymerizations were investigated with two catalysts to find evidence of multisite behavior. It was observed that catalyst systems 1/Ph 3C][B-(C 6F 5) 4] and 2/Ph 3C][B(C 6F 5) 4] produced polypropylene samples with broad molecular weight distributions.
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Nagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, JapanNagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Matsumoto, Kentaro
Sandhya, Karakkadparambil Sankaran
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Nagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Japan Sci & Technol Agcy, Core Res Evolut Sci & Technol, Honmachi, Kawaguchi, Saitama 3320012, JapanNagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Sandhya, Karakkadparambil Sankaran
Takayanagi, Masayoshi
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Nagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Japan Sci & Technol Agcy, Core Res Evolut Sci & Technol, Honmachi, Kawaguchi, Saitama 3320012, JapanNagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Takayanagi, Masayoshi
Koga, Nobuaki
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Nagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Japan Sci & Technol Agcy, Core Res Evolut Sci & Technol, Honmachi, Kawaguchi, Saitama 3320012, JapanNagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Koga, Nobuaki
Nagaoka, Masataka
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Nagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan
Japan Sci & Technol Agcy, Core Res Evolut Sci & Technol, Honmachi, Kawaguchi, Saitama 3320012, Japan
Kyoto Univ Katsura, Elements Strategy Initiat Catalysts & Batteries E, Kyoto 6158520, JapanNagoya Univ, Grad Sch Informat Sci, Chikusa Ku, Furo Cho, Nagoya, Aichi 4648601, Japan