Unified regression model in fitting potential energy surfaces for quantum dynamics

DOI10.1007/S10910-022-01400-4OpenAlexW4294912043MaRDI QIDQ2084807

Qingfei Song, Qingyong Meng, Qiuyu Zhang, Zekai Miao, XingYu Zhang

Publication date: 13 October 2022

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-022-01400-4

Mathematics Subject Classification ID

Artificial intelligence (68Txx) Computer science (68-XX)

Uses Software

• MOLPRO

Cites Work

• Bayesian learning for neural networks
• On the eigenvector bias of Fourier feature networks: from regression to solving multi-scale PDEs with physics-informed neural networks
• 10.1162/15324430152733142
• Mathematics for Machine Learning

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