Yu Jin1, Hang-Biao Lv1, Shisheng Zheng1

  • 1College of Energy, State Key Laboratory of Physical Chemistry of Solid Surfaces, iChEM, College of Chemistry and Chemical Engineering, Institute of Artificial Intelligence, Xiamen University, Xiamen 361005, Fujian, China. zhengss@xmu.edu.cn.

概括

特性工程正在推进机器学习,用于材料发现的异质催化. 本综述详细介绍了其从基本描述符到复杂的多式联运表示的演变,强调了当前的挑战和未来的方向.

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