Original language | English |
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Pages (from-to) | 416-425 |
Journal | Journal of Physical Chemistry A |
Volume | 105 |
Issue number | 2 |
DOIs | |
Publication status | Published - 2001 |
g- and a-tensor calculations in the zero-order approximation for relativistic effects of Ni complexes Ni(mnt)(2)(-) and Ni(CO)(3)H as model complexes for the active center of [NiFe]-hydrogenase
M. Stein, E. van Lenthe, E.J. Baerends, W. Lubitz
Research output: Contribution to Journal › Article › Academic › peer-review