Theoretical study of iron acyl complexes modeling the active site of [Fe]-hydrogenase: Solvation effects play a significant role

Theoretical study of iron acyl complexes modeling the active site of [Fe]-hydrogenase: Solvation effects play a significant role

Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computational and Theoretical Chemistry - Volume 1064, 15 July 2015, Pages 45-50

Chaozheng Li, Zhiqiang Fu, Xiaoqian Zhang, Yufang Liu, Yong Wang,