[P01-1am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

[P01-1am-02] Prediction of Gas Phase Acidity for in Silico Design of Super Acids with High Precision Quantum Chemical Calculations and Machine Learning

^○Rima Suzuki¹, Nahoko Kuroki¹, Hirotoshi Mori^1,2 (1. Chuo University, 2. Institute for Molecular Science)

[Lang.] Japanese

Keywords:Superacid, Gas Phase Acidity, Quantum Chemical Calculation, Machine Learning, Materials Informatics