1. High precision theoretical research on chemical reactions related to combustion, celestial bodies, atmosphere, and atmospheric weather dynamics: prediction and identification of key species, reaction mechanism models, competition mechanisms, energy transfer mechanisms, high-precision thermodynamics, novel kinetic mechanisms, etc., serving to improve combustion efficiency, detect interstellar molecules, and prevent and control atmospheric pollution.

2. Molecular dynamics research on typical elementary reactions: The ultimate goal of precise control of chemical reactions requires understanding and describing the fundamental nature of complex chemical reaction kinetics at the atomic, molecular, and other microscopic levels. Develop relevant methods, provide microscopic details through high-precision theoretical calculations, reproduce/interpret/predict experiments, reveal mechanisms, and summarize patterns.

3. Application and Development of Artificial Intelligence and Big Data in Chemistry: In the era of artificial intelligence and big data, computing is equally important as theory and experimentation, and science has evolved into data-driven science. Data quality, sampling, representation, storage, standardization, and visualization have become particularly important. Develop methods to build high-precision basic chemical databases for energy, atmosphere, combustion, interstellar, and other fields.