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Updated: Jan 11, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry

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增强双金属集群的全球优化:一个自适应的多策略差异演化算法

Xiaomin Wu1, Miao He2, Yousi Lin1

  • 1School of Opto-Electronic and Communication Engineering, Xiamen University of Technology, Xiamen, China. wuxiaomin@xmut.edu.cn.

Nanoscale
|November 10, 2025
PubMed
概括

我们开发了一个自适应的多策略差异演化 (AMSDE) 算法,以找到双金属的最低能量结构. 这种新方法为纳米合金设计提供了更快的融合和更好的稳定性.

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Protein WISDOM: A Workbench for In silico De novo Design of BioMolecules

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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics10:52

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

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相关概念视频

Mechanistic Models: Compartment Models in Algorithms for Numerical Problem Solving01:29

Mechanistic Models: Compartment Models in Algorithms for Numerical Problem Solving

Mechanistic models play a crucial role in algorithms for numerical problem-solving, particularly in nonlinear mixed effects modeling (NMEM). These models aim to minimize specific objective functions by evaluating various parameter estimates, leading to the development of systematic algorithms. In some cases, linearization techniques approximate the model using linear equations.
In individual population analyses, different algorithms are employed, such as Cauchy's method, which uses a...
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