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The last 5 uploaded publications
Electronic Structures of Octahedral Ni(II) Complexes with “Click” Derived Triazole Ligands: A Combined Structural, Magnetometric, Spectroscopic, and Theoretical Study
David Schweinfurth, J. Krzystek, Igor Schapiro, Serhiy Demeshko, Johannes E. M. N. Klein, Joshua Telser, Andrew Ozarowski, Cheng‐Yong Su, Franc Meyer, Mihail Atanasov, Frank Neese, Biprajit Sarkar (2013). Electronic Structures of Octahedral Ni(II) Complexes with “Click” Derived Triazole Ligands: A Combined Structural, Magnetometric, Spectroscopic, and Theoretical Study. Inorganic Chemistry, 52(12), pp. 6880-6892, DOI: 10.1021/ic3026123.
Article169 days agoFamily of V(III)-Tristhiolato Complexes Relevant to Functional Models of Vanadium Nitrogenase: Synthesis and Electronic Structure Investigations by Means of High-Frequency and -Field Electron Paramagnetic Resonance Coupled to Quantum Chemical Computations.
Shengfa Ye, Frank Neese, Andrew Ozarowski, Dmitry Smirnov, J. Krzystek, Joshua Telser, Ju‐Hsiou Liao, Chen‐Hsiung Hung, Wei-Chen Chu, Yi-Feng Tsai, Rong-Chin Wang, Kun-Yuan Chen, Hua‐Fen Hsu (2009). Family of V(III)-Tristhiolato Complexes Relevant to Functional Models of Vanadium Nitrogenase: Synthesis and Electronic Structure Investigations by Means of High-Frequency and -Field Electron Paramagnetic Resonance Coupled to Quantum Chemical Computations.. Inorganic Chemistry, 49(3), pp. 977-988, DOI: 10.1021/ic9017745.
Article169 days agoElectronic Structure of Nickel(II) and Zinc(II) Borohydrides from Spectroscopic Measurements and Computational Modeling
Patrick J. Desrochers, Christopher Sutton, Micah L. Abrams, Shengfa Ye, Frank Neese, Joshua Telser, Andrew Ozarowski, J. Krzystek (2012). Electronic Structure of Nickel(II) and Zinc(II) Borohydrides from Spectroscopic Measurements and Computational Modeling. Inorganic Chemistry, 51(5), pp. 2793-2805, DOI: 10.1021/ic201775c.
Article169 days agoCCDC 910984: Experimental Crystal Structure Determination
David Schweinfurth, J. Krzystek, Igor Schapiro, Serhiy Demeshko, Johannes E. M. N. Klein, Joshua Telser, Andrew Ozarowski, Cheng‐Yong Su, Franc Meyer, Mihail Atanasov, Frank Neese, Biprajit SarkarCCDC 910984: Experimental Crystal Structure Determination. , DOI: https://doi.org/10.5517/cczkyl1.
Dataset49 days agoCCDC 910983: Experimental Crystal Structure Determination
David Schweinfurth, J. Krzystek, Igor Schapiro, Serhiy Demeshko, Johannes E. M. N. Klein, Joshua Telser, Andrew Ozarowski, Cheng‐Yong Su, Franc Meyer, Mihail Atanasov, Frank Neese, Biprajit SarkarCCDC 910983: Experimental Crystal Structure Determination. , DOI: https://doi.org/10.5517/cczkyk0.
Dataset49 days ago