| 1 |
Theoretical Determination of the Zero-Field Splitting in Copper Acetate Monohydrate
Maurice R, Sivalingam K, Ganyushin D, Guihery N, de Graaf C, Neese F
Inorganic Chemistry, 50(13), 6229, 2011 |
| 2 |
Detailed Ab Initio First-Principles Study of the Magnetic Anisotropy in a Family of Trigonal Pyramidal Iron(II) Pyrrolide Complexes
Atanasov M, Ganyushin D, Pantazis DA, Sivalingam K, Neese F
Inorganic Chemistry, 50(16), 7460, 2011 |
| 3 |
Systematic Theoretical Study of the Zero-Field Splitting in Coordination Complexes of Mn(III). Density Functional Theory versus Multireference Wave Function Approaches
Duboc C, Ganyushin D, Sivalingam K, Collomb MN, Neese F
Journal of Physical Chemistry A, 114(39), 10750, 2010 |
| 4 |
Direct Detection and Characterization of Chloride in the Active Site of the Low-pH Form of Sulfite Oxidase Using Electron Spin Echo Envelope Modulation Spectroscopy, Isotopic Labeling, and Density Functional Theory Calculations
Klein EL, Astashkin AV, Ganyushin D, Riplinger C, Johnson-Winters K, Neese F, Enemark JH
Inorganic Chemistry, 48(11), 4743, 2009 |
| 5 |
A Multiconfigurational ab Initio Study of the Zero-Field Splitting in the Di- and Trivalent Hexaquo-Chromium Complexes
Liakos DG, Ganyushin D, Neese F
Inorganic Chemistry, 48(22), 10572, 2009 |
