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Updated: Sep 9, 2025

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化学結合と潜在エネルギー表面の性質の軌道視野:ホモポラー二原子分子に関するウォールの分子軌道表現から55年

Yasuki Arasaki1, Kazuo Takatsuka1

  • 1Fukui Institute for Fundamental Chemistry, Kyoto University, 606-8103 Kyoto, Japan. kaztak@fukui.kyoto-u.ac.jp.

Physical chemistry chemical physics : PCCP
|September 3, 2025
PubMed
まとめ

化学反応の潜在エネルギー表面を追跡する ENOXを導入します ENOXは,分子電子エネルギー変化の軌道エネルギービューを提供し,化学結合形成の分析を簡素化します.

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