What Is the Active Site for the Oxidative Coupling of Methane Catalyzed by MgO? A Metadynamics-Biased Ab Initio Molecular Dynamics Study | 研究者総覧SAMURAI - 物質・材料研究機構 (NIMS)

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What Is the Active Site for the Oxidative Coupling of Methane Catalyzed by MgO? A Metadynamics-Biased Ab Initio Molecular Dynamics Study

Atsushi Ishikawa, Yoshitaka Tateyama.

The Journal of Physical Chemistry C 124 [11] 6054-6062. 2020.

https://doi.org/10.1021/acs.jpcc.9b09959

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作成時刻: 2020-05-12 03:00:17 +0900 更新時刻: 2026-11-08 04:55:30 +0900

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