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pyHRMC:混合逆蒙特卡洛对电子的总散射

Karen M Ehrhardt1, Jack D Sundberg1, Scott C Warren1

  • 1Department of Chemistry, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina, USA.

Journal of computational chemistry
|January 19, 2026
PubMed
概括

研究人员开发了pyHRMC,这是一个用于分析电子散射数据的Python包. 这种工具增强了无形纳米材料的结构特征,克服了以前方法的局限性.

关键词:
无形材料是无形的材料.电子散射是一种电子散射.混合动力反向蒙特卡洛车建模 建模模型 建模模型

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