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Practical approach for beryllium atomic clusters: TD-DFT potential energy surfaces from equilibrium to dissociation for excited states of 2s → 2p

Crossref DOI link: https://doi.org/10.1007/s00214-018-2324-y

Published Online: 2018-10-08

Published Print: 2018-10

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Xu, Liang

Xu, Yuqing

Cheung, Nai-Ho

Wong, Kin-Yiu https://orcid.org/0000-0001-9745-3345
Funding

Funding for this research was provided by:

Hong Kong Baptist University (38-40-088)

Hong Kong Baptist University (FRG2/15-16/037)

Hong Kong Baptist University (FRG1/14-15/037)

Hong Kong Baptist University (FRG1/15-16/015)

Hong Kong Baptist University (FRG2/13-14/075)

Hong Kong Research Grants Council (ECS-209813)

Hong Kong Research Grants Council (GRF-12311416)

National Natural Science Foundation of China (NSFC-21303151)

National Natural Science Foundation of China (NSFC-21673199)
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Article History

Received: 8 May 2018

Accepted: 25 September 2018

First Online: 8 October 2018