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• W2017193735 abstract "DFT calculations are reported for all possible insertions of ethene and propene in rac-Me2SiInd2Zr−R⎤+ and Me2C(Cp)(Flu)Zr−R⎤+ (R = Et and iPr). The results confirm the basic stereoregulation mechanism of Corradini. In addition, they provide an ordering of the possible sources of stereoerrors: chain misorientation is the main mechanism for unbranched (Et, nPr) chains, whereas for the β-branched iBu chain errors due to chain misorientation and chain−olefin syn orientation are equally likely." @default.
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• W2017193735 date "2003-09-24" @default.
• W2017193735 modified "2023-09-27" @default.
• W2017193735 title "Selectivity of Metallocene-Catalyzed Olefin Polymerization: A Combined Experimental and Quantum Mechanical Study. The <i>a</i><i>nsa</i>-Me₂Si(Ind)₂Zr and <i>a</i><i>nsa</i>-Me₂C(Cp)(Flu)Zr Systems" @default.
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• W2017193735 doi "https://doi.org/10.1021/ma034990v" @default.
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