Amazing movie of dancing orbitals (aka charge transfer dynamics) from Felix over at Chemical Quantum Images.
Posts
Lifelong Machine Learning Potentials
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Marco Eckhoff and Markus Reiher (2023)
Highlighted by Jan Jensen
While machine learning potentials (MLPs) can give you DFT accuracy at FF
costs, they als...
3 weeks ago
1 comment:
hi, thanks. glad you like it.
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