exercises:common:reading_list
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| exercises:common:reading_list [2023/12/05 13:23] – fnunes | exercises:common:reading_list [2025/12/29 04:44] (current) – [Papers] jglan | ||
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| * CPMD: Unified Approach for Molecular Dynamics and Density-Functional Theory, Roberto Car and Michele Parrinello (DOI: https:// | * CPMD: Unified Approach for Molecular Dynamics and Density-Functional Theory, Roberto Car and Michele Parrinello (DOI: https:// | ||
| - | * Metadynamics: Escaping free-energy minima, Alessandro Laio and Michele Parrinello (DOI: https:// | + | * Metadynamics: Escaping free-energy minima, Alessandro Laio and Michele Parrinello (DOI: https:// |
| * Real-time methods: Real-Time Time-Dependent Electronic Structure Theory, Xiaosong Li, Niranjan Govind, Christine Isborn, A. Eugene DePrince III, and Kenneth Lopata (DOI: https:// | * Real-time methods: Real-Time Time-Dependent Electronic Structure Theory, Xiaosong Li, Niranjan Govind, Christine Isborn, A. Eugene DePrince III, and Kenneth Lopata (DOI: https:// | ||
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| * DeepMD: Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics, Linfeng Zhang, Jiequn Han, Han Wang, Roberto Car, and Weinan E (DOI: https:// | * DeepMD: Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics, Linfeng Zhang, Jiequn Han, Han Wang, Roberto Car, and Weinan E (DOI: https:// | ||
| + | * MACE: A foundation model for atomistic materials chemistry, Ilyes Batatia et al. (DOI: https:// | ||
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| + | * E3NN: e3nn: Euclidean Neural Networks, Mario Geiger, Tess Smidt (DOI: https:// | ||
exercises/common/reading_list.1701782602.txt.gz · Last modified: by fnunes
