Chapter on Machine Learning in Quantum Chemistry in a Tutorial Way
My book chapter shows in a tutorial way how to use machine learning to assist quantum chemistry research. The chapter – available for free download till November 6 – is a part of the book edited by Kenneth Ruud and Erkki J. Brändas. It collects a dozen of contributions to the 10th Triennial Congress of the International Society for Theoretical Chemical Physics (ISTCP-X). This was a huge congress with 500 participants. It was held in pre-COVID-19 times in Tromsø, Norway, where the sun never set below the horizon at that time of the year. The team of the organizers led by Kenneth Ruud did really amazing job to bring together forefront science in chemical physics.
Sep-28-2020, 12:40:07 GMT