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Nature Chemistry|September 24, 2020
Deep-neural-network solution of the electronic Schrödinger equationJan Hermann, Zeno Schätzle, Frank NoéJournal of Chemical Theory and Computation|August 30, 2024
An Improved Penalty-Based Excited-State Variational Monte Carlo Approach with Deep-Learning AnsatzesP Bernát Szabó, Zeno Schätzle, Michael T Entwistle, et al.The Journal of Chemical Physics|August 27, 2025
Partitioning the electronic wave function using deep variational Monte CarloMatěj Mezera, Paolo A Erdman, Zeno Schätzle, et al.The Journal of Chemical Physics|July 15, 2025
Deep quantum Monte Carlo approach for polaritonic chemistryYifan Tang, Gian Marcello Andolina, Alice Cuzzocrea, et al.The Journal of Chemical Physics|January 21, 2025
Highly accurate real-space electron densities with neural networksLixue Cheng, P Bernát Szabó, Zeno Schätzle, et al.Pageof 1