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Theoretical prediction of g tensors and hyperfine coupling tensors of triplet molecules

✍ Scribed by Y. J. I'haya; Tetsuo Morikawa; Junji Nakano

Book ID
104579721
Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
448 KB
Volume
16
Category
Article
ISSN
0020-7608

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Evaluation of hyperfine coupling tensors
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✍ Berta Fernandez; Poul JΓΈrgensen πŸ“‚ Article πŸ“… 1995 πŸ› Elsevier Science 🌐 English βš– 644 KB

Using the multiconfigurational self-consistent field restricted-unrestricted response function approach and following a systematic basis set and electron correlation study, accurate hyperfine coupling tensors have been determined for the X 2Z states of the Bell and the BeF radicals. The basis set in