Eric Djäknegren
Visar 12 publikationer
NEP89: universal neuroevolution potential for inorganic and organic materials across 89 elements
Through Rainbow-Tinted Glasses: Machine Learning-Driven Modeling of Chromophores
Dynasor 2: From simulation to experiment through correlation functions
Probing Glass Formation in Perylene Derivatives via Atomic-Scale Simulations and Bayesian Regression
Predicting neutron experiments from first principles: a workflow powered by machine learning
General-purpose machine-learned potential for 16 elemental metals and their alloys
Machine Learning for Polaritonic Chemistry: Accessing Chemical Kinetics
calorine: A Python package for constructing and sampling neuroevolution potential models
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