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Machine Learning the Quantum Mechanical Wave Function.

Mandira DeyDebashree Ghosh
Published in: The journal of physical chemistry. A (2023)
Strongly correlated systems have been challenging to computational chemists for a long time. To solve these systems, multireference methods have been developed over the years. Recently, with the fast development of machine learning and artificial intelligence methods, these methods have also influenced the quest for optimal wave function ansatz. Machine learning approaches have been used in many different flavors. From this perspective, we will discuss the different milestones achieved in the use of machine learning for solving the quantum many body problem.
Keyphrases
  • machine learning
  • artificial intelligence
  • big data
  • deep learning
  • molecular dynamics