The favorable routes for the hydrolysis of CH 2 OO with (H 2 O) n ( n = 1–4) investigated by global minimum searching combined with quantum chemical methods

• Published in: Physical chemistry chemical physics : PCCP Vol. 23; no. 22; pp. 12749 - 12760
• Main Authors: Wang, Rui, Wen, Mingjie, Liu, Shuai, Lu, Yousong, Makroni, Lily, Muthiah, Balaganesh, Zhang, Tianlei, Wang, Zhiyin, Wang, Zhuqing
• Format: Journal Article
• Language: English
• Published: 09.06.2021

The hydrolysis reaction of CH 2 OO with water and water clusters is believed to be a dominant sink for the CH 2 OO intermediate in the atmosphere. However, the favorable route for the hydrolysis of CH 2 OO with water clusters is still unclear. Here global minimum searching using the Tsinghua Global...