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Updated: Jul 22, 2025

Methods of Ex Situ and In Situ Investigations of Structural Transformations: The Case of Crystallization of Metallic Glasses
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Published on: June 7, 2018

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新密度矩阵重规范化小组对与大环境相结合的强相关系统的方法

Yihe Xu1, Yifan Cheng1, Yinxuan Song1

  • 1School of Chemistry and Chemical Engineering, Nanjing University, Nanjing 210023, China.

Journal of chemical theory and computation
|July 20, 2023
PubMed
概括

新的计算方法增强了密度矩阵重规范化组 (DMRG),用于模拟复杂的分子系统. 这些进步使得与大环境相互作用的强相关分子的准确建模成为可能.

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