Superatom Molecular Orbitals of Li@C₆₀: Effects of the Li Position and the Substrate

Authors

• Artem V. Kuklin
• Rahul Suresh, School of Physics, Clinical and Optometric Sciences
• Konoha Shimizu
• Yoichi Yamada
• Hans Ågren

ORCID

• Rahul Suresh: 0000-0002-6354-0886

Publication Date

2022-09-22

Publication Title

Journal of Physical Chemistry C

Volume

126

Issue

37

ISSN

1932-7447

First Page

15891

Last Page

15898

Deposit Date

2026-07-08

Funding

R.S. acknowledges the support of the Russian Science Foundation (Project 19-73-10015). This work was also supported by the Olle Engkvist Byggmästare Foundation (contract no. 212-0178), JSPS KAKENHI Grant Numbers 20H02808 and 19K05182, and partly performed under the approval of the Photon Factory Program Advisory Committee (2018S2-005) and UVSOR (20-260). The authors thank the Swedish National Infrastructure for Computing (SNIC 2021-3-22) at the National Supercomputer Centre of Linköping University (Sweden), partially funded by the Swedish Research Council through grant agreement no. SNIC 2021/3-22 and 2021/6-335.

Creative Commons License

This work is licensed under a Creative Commons Attribution 4.0 International License.

Additional Links

https://pubs.acs.org/doi/10.1021/acs.jpcc.2c02098, https://www.scopus.com/pages/publications/85139217011

Recommended Citation

Kuklin, Artem V.; Suresh, Rahul; Shimizu, Konoha; Yamada, Yoichi; and Ågren, Hans, "Superatom Molecular Orbitals of Li@C₆₀: Effects of the Li Position and the Substrate" (2022). Research Outputs: 2025-Present. 8.
https://arrow.tudublin.ie/scschphyro/8