Publikationen von Dmytro Bykov
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Zeitschriftenartikel (4)
2015
Zeitschriftenartikel
113 (13-14), S. 1961 - 1977 (2015)
Efficient implementation of the analytic second derivatives of Hartree–Fock and hybrid DFT energies: a detailed analysis of different approximations. Molecular Physics 2014
Zeitschriftenartikel
19 (1), S. 97 - 112 (2014)
Heme-bound nitroxyl, hydroxylamine, and ammonia ligands as intermediates in the reaction cycle of cytochrome c nitrite reductase: a theoretical study. Journal of Biological Inorganic Chemistry 2013
Zeitschriftenartikel
110 (28), E2539 (2013)
Reply to Mouesca et al.: Electronic structure of the proximal [4Fe-3S] cluster of O2-tolerant [NiFe] hydrogenases. Proceedings of the National Academy of Sciences of the United States of America
Zeitschriftenartikel
110 (2), S. 483 - 488 (2013)
Electronic structure of the unique [4Fe-3S] cluster in O2-tolerant hydrogenases characterized by 57Fe Mössbauer and EPR spectroscopy. Proceedings of the National Academy of Sciences of the United States of America