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Exact two-component relativistic energy band theory and application

Rundong Zhao1, Yong Zhang1, Yunlong Xiao1

  • 1Beijing National Laboratory for Molecular Sciences, Institute of Theoretical and Computational Chemistry, State Key Laboratory of Rare Earth Materials Chemistry and Applications, College of Chemistry and Molecular Engineering, and Center for Computational Science and Engineering, Peking University, Beijing 100871, People's Republic of China.

The Journal of Chemical Physics
|February 1, 2016
PubMed

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