论文部分内容阅读
光合放氧复合物是位于光系统II中氧化水的催化中心。对其结构、性质以及催化机理的研究不仅能够深入了解植物光合作用机制,也是人工合成稳定、高效、廉价的水氧化催化剂的基础。由于光合放氧复合物结构的复杂性,现代计算量子化学方法在对其研究中起着极为重要的作用。本文综述了天然水氧化催化剂的理论研究进展,总结了理论研究工作的重点,并展望了未来的发展方向。
The photosynthetic oxygen complex is the catalytic center of oxidized water located in Photo System II. The study of its structure, properties and catalytic mechanism can not only understand the mechanism of plant photosynthesis, but also the basis for the synthesis of stable, efficient and cheap water oxidation catalysts. Due to the complexity of the structure of photosynthetic oxygen evolution complex, modern computational quantum chemistry plays a very important role in its research. This review summarizes the theoretical research progress of natural water oxidation catalysts, summarizes the key points of theoretical research work, and looks forward to the future direction of development.