Electronic properties of the coronene series from thermally-assisted-occupation density functional theory

Author:

Yeh Chia-Nan1234ORCID,Wu Can5678,Su Haibin56789ORCID,Chai Jeng-Da123410ORCID

Affiliation:

1. Department of Physics

2. National Taiwan University

3. Taipei 10617

4. Taiwan

5. School of Materials Science and Engineering

6. Nanyang Technological University

7. Singapore 639798

8. Republic of Singapore

9. Department of Chemistry

10. Center for Theoretical Physics

Abstract

To fully utilize the great potential of graphene in electronics, a comprehensive understanding of the electronic properties of finite-size graphene flakes is essential.

Funder

Ministry of Science and Technology, Taiwan

Ministry of Education - Singapore

National Taiwan University

National Center for Theoretical Sciences

Hong Kong University of Science and Technology

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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