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Scalar relativistic calculations of hyperfine coupling constants using ab initio density matrix renormalization group

Tran Nguyen Lan1, Yuki Kurashige1,2,3, Takeshi Yanai1,2

  • 1The Graduate University for Advanced Studies , Myodaiji, Okazaki, Aichi 444-8585, Japan.

Journal of Chemical Theory and Computation
|November 18, 2015
PubMed

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