Publications of Mihail Atanasov

Liu, W.; Christian, J. H.; Al-Oweini, R.; Bassil, B. S.; van Tol, J.; Atanasov, M.; Neese, F.; Dalal, N. S.; Kortz, U. Synthesis, Detailed Characterization, and Theoretical Understanding of Mononuclear Chromium(III)-Containing Polyoxotungstates [Cr^III(HX^VW₇O₂₈)₂]^13– (X = P, As) with Exceptionally Large Magnetic Anisotropy. Inorganic Chemistry 2014, 53, 9274–9283.

Pollock, C. J.; Delgado-Jaime, M. U.; Atanasov, M.; Neese, F.; DeBeer, S. Kβ Mainline X-Ray Emission Spectroscopy as an Experimental Probe of Metal–Ligand Covalency. Journal of the American Chemical Society 2014, 136, 9453–9463.

Zadrozny, J. M.; Xiao, D. J.; Long, J. R.; Atanasov, M.; Neese, F.; Grandjean, F.; Long, G. J. Mössbauer Spectroscopy as a Probe of Magnetization Dynamics in the Linear Iron(I) and Iron(II) Complexes [Fe(C(SiMe₃)₃)₂]^1–/0. Inorganic Chemistry 2013, 52, 13123–13131.

Zadrozny, J. M.; Xiao, D. J.; Atanasov, M.; Long, G. J.; Grandjean, F.; Neese, F.; Long, J. R. Magnetic Blocking in a Linear Iron(I) Complex. Nature Chemistry 2013, 5, 577–581.

Schweinfurth, D.; Krzystek, J.; Schapiro, I.; Demeshko, S.; Klein, J.; Telser, J.; Ozarowski, A.; Su, C.-Y.; Meyer, F.; Atanasov, M.; Neese, F.; Sarkar, B. Electronic Structures of Octahedral Ni(II) Complexes with “Click” Derived Triazole Ligands: A Combined Structural, Magnetometric, Spectroscopic, and Theoretical Study. Inorganic Chemistry 2013, 52, 6880–6892.

Atanasov, M.; Surawatanawong, P.; Wieghardt, K.; Neese, F. A Theoretical Study of Zero-Field Splitting in Fe(IV)S₆ (S = 1) and Fe(III)S₆ (S = 1/2) Core Complexes, [Fe^IV(Et₂Dtc)_3−n(Mnt)_n]⁽ⁿ⁻¹⁾⁻ and [Fe^III(Et₂Dtc)_3−n(Mnt)_n]ⁿ⁻ (n = 0, 1, 2, 3): The Origin of the Magnetic Anisotropy. Coordination Chemistry Reviews 2013, 257, 27–41.

Atanasov, M.; Zadrozny, J. M.; Long, J. R.; Neese, F. A Theoretical Analysis of Chemical Bonding, Vibronic Coupling, and Magnetic Anisotropy in Linear Iron(II) Complexes with Single-Molecule Magnet Behavior. Chemical Science 2013, 4, 139–156.

Zadrozny, J. M.; Atanasov, M.; Bryan, A. M.; Lin, C.-Y.; Rekken, B. D.; Power, P. P.; Neese, F.; Long, J. R. Slow Magnetization Dynamics in a Series of Two-Coordinate Iron(II) Complexes. Chemical Science 2013, 4, 125–138.

Atanasov, M.; Comba, P.; Helmle, S.; Müller, D.; Neese, F. Zero-Field Splitting in a Series of Structurally Related Mononuclear Ni^II–Bispidine Complexes. Inorganic Chemistry 2012, 51, 12324–12335.

Atanasov, M.; Ganyushin, D.; Pantazis, D. A.; Sivalingam, K.; Neese, F. Detailed Ab Initio First-Principles Study of the Magnetic Anisotropy in a Family of Trigonal Pyramidal Iron(II) Pyrrolide Complexes. Inorganic Chemistry 2011, 50, 7460–7477.

Atanasov, M.; Delley, B.; Neese, F.; Tregenna-Piggott, P. L.; Sigrist, M. Theoretical Insights into the Magnetostructural Correlations in Mn₃-Based Single-Molecule Magnets. Inorganic Chemistry 2011, 50, 2112–2124.

Atanasov, M.; Ganyushin, D.; Sivalingam, K.; Neese, F. A Modern First-Principles View on Ligand Field Theory Through the Eyes of Correlated Multireference Wavefunctions; Mingos, D. M. P., Day, P., Eds.; Mingos, D. M. P., Day, P., Series Eds.; Structure and Bonding: Molecular Electronic Structures of Transition Metal Complexes II; Springer: Berlin, Heidelberg, 2012; Vol. 143, pp 149–220.