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Molecular Forcefield Methods for Describing Energetic Molecular Crystals: A Review

Energetic molecular crystals are widely applied for military and civilian purposes, and molecular forcefields (FF) are indispensable for treating the microscopic issues therein. This article reviews the three types of molecular FFs that are applied widely for describing energetic crystals—classic FF...

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Autors principals: Wen Qian, Xianggui Xue, Jian Liu, Chaoyang Zhang
Format: Artigo
Idioma:Inglês
Publicat: MDPI AG 2022-02-01
Col·lecció:Molecules
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Accés en línia:https://www.mdpi.com/1420-3049/27/5/1611
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