Electronic state calculation of the oxygen-evolving Mn4Ca complex for the artificial photosynthesis
Yuki Yoshida, Takahiro Ishibashi, Tomohiko Ishii, and Genta Sakane
cluster complex, mixed-metal, bond overlap population, DV-Xα, cubane-type cluster
Bulletin of the Society for Discrete Variational Xα
The Society for Discrete Variational Xα
26
1&2
188
194