Lattice Kinetic Monte Carlo (KMC) Simulations for Subnanometer Pdn clusters Dynamics under a pressure of CO.
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Sep 6, 2021 - Python
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atomic-simulations
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Dataset, machine learning models and Monte Carlo simulations in Python for subnanometer CO-adsorbed Pd clusters supported on Ceria
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Dec 15, 2021 - Python
Atomic Latent Signatures, encoders for crystal structures
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Nov 22, 2024 - Python
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