Origin of Reactivity Trends of Noble-Gas Endohedral Fullerenes Ng2@C60 (Ng = He to Xe)

I. Fernandez; M. Sola; F.M. Bickelhaupt

doi:10.1021/ct500444z

Origin of Reactivity Trends of Noble-Gas Endohedral Fullerenes Ng2@C60 (Ng = He to Xe)

Research output: Contribution to Journal › Article › Academic › peer-review

Abstract

We have computationally studied the factors governing the enhanced Diels-Alder reactivity of noble gas endohedral fullerenes Ng

Original language	English
Pages (from-to)	3863-3870
Journal	Journal of Chemical Theory and Computation
Issue number	10
DOIs	https://doi.org/10.1021/ct500444z
Publication status	Published - 2014

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title = "Origin of Reactivity Trends of Noble-Gas Endohedral Fullerenes Ng2@C60 (Ng = He to Xe)",

abstract = "We have computationally studied the factors governing the enhanced Diels-Alder reactivity of noble gas endohedral fullerenes Ng",

author = "I. Fernandez and M. Sola and F.M. Bickelhaupt",

year = "2014",

doi = "10.1021/ct500444z",

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journal = "Journal of Chemical Theory and Computation",

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AU - Fernandez, I.

AU - Sola, M.

AU - Bickelhaupt, F.M.

PY - 2014

Y1 - 2014

N2 - We have computationally studied the factors governing the enhanced Diels-Alder reactivity of noble gas endohedral fullerenes Ng

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JO - Journal of Chemical Theory and Computation

JF - Journal of Chemical Theory and Computation

IS - 10

ER -

Origin of Reactivity Trends of Noble-Gas Endohedral Fullerenes Ng2@C60 (Ng = He to Xe)

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