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Cited article:

Quantum Chemical Studies on Dioxygen Activation and Methane Hydroxylation by Diiron and Dicopper Species as well as Related Metal–Oxo Species

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Exchange Interactions in Systems with Multiple Magnetic Sites

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The Journal of Physical Chemistry A 114 (24) 6641 (2010)
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DFT Description of the Electronic Structure and Spectromagnetic Properties of Strongly Correlated Electronic Systems: NiII, CuII and ZnIIo‐Dioxolene Complexes

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Chemistry – A European Journal 10 (6) 1472 (2004)
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A Non‐Radical Mechanism for Methane Hydroxylation at the Diiron Active Site of Soluble Methane Monooxygenase

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Chemistry – A European Journal 9 (10) 2347 (2003)
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Charge Distribution in Bis-Dioxolene Radical Metal Complexes. Synthesis and DFT Characterization of Dinuclear Co(III) and Cr(III) Complexes with a Mixed-Valent, S = 1/2 Semiquinone-Catecholate Ligand

Alessandro Bencini, Claude A. Daul, Andrea Dei, et al.
Inorganic Chemistry 40 (7) 1582 (2001)
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DFT Description of Mixed Valence Magnetic Systems. Mn(III)-Mn(IV) and Fe(II)-Fe(III) Complexes

Alessandro Bencini, Dante Gatteschi, Maurizio Mattesini, Federico Totti and Ilaria Ciofini
Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals 335 (1) 665 (1999)
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Density Functional Modeling of Double Exchange Interactions in Transition Metal Complexes. Calculation of the Ground and Excited State Properties of [Fe2(OH)3(tmtacn)2]2+

Vincenzo Barone, Alessandro Bencini, Ilaria Ciofini, Claude A. Daul and Federico Totti
Journal of the American Chemical Society 120 (33) 8357 (1998)
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Density Functional Calculations of Magnetic Exchange Interactions in Polynuclear Transition Metal Complexes

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Inorganic Chemistry 36 (22) 5022 (1997)
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Toward the Prediction of Magnetic Coupling in Molecular Systems:  Hydroxo- and Alkoxo-Bridged Cu(II) Binuclear Complexes

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Double-exchange interactions in the mixed-valence hexanuclear octahedral clusters [Fe6(μ3-X)8)(PEt3)6]+(X = S, Se)

Alessandro Bencini, Andrew V. Palii, Sergei M. Ostrovsky, Boris S. Tsukerblat and Myriam G. Uytterhoeven
Molecular Physics 86 (5) 1085 (1995)
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Electronic structure of paramagnetic clusters of transition metal ions. 3. Magnetic properties and scattered wave description of the electronic structure of the hexanuclear octahedral cluster [Fe6(μ3−S)8(PEt3)6] (BPh4)2

Alessandro Bencini, Myriam G. Uytterhoeven and Claudia Zanchini
International Journal of Quantum Chemistry 52 (4) 903 (1994)
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Some synthetic and theoretical aspects of the chemistry of polynuclear transition-metal complexes

Alessandro Bencini and Stefano Midollini
Coordination Chemistry Reviews 120 87 (1992)
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