Theoretical Framework Based on Molecular Dynamics and Data Mining Analyses for the Study of Potential Energy Surfaces of Finite-Size Particles
Author:
Affiliation:
1. São Carlos Institute of Chemistry, University of São Paulo, P.O. Box 780, 13560-970 São Carlos, São Paulo, Brazil
2. Institute of Science and Technology, Federal University of São Paulo, 01016 020 São José dos Campos, São Paulo, Brazil
Funder
Funda??o de Amparo ? Pesquisa do Estado de S?o Paulo
Shell
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.2c00957
Reference41 articles.
1. Quantum effects on the structure of pure and binary metallic nanoclusters
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3. The Role of Charge States in the Atomic Structure of Cun and Ptn (n = 2–14 atoms) Clusters: A DFT Investigation
4. Ab Initio Insights into the Formation Mechanisms of 55-Atom Pt-Based Core–Shell Nanoalloys
5. Electrochemistry of Atomically Precise Metal Nanoclusters
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