Electronic Structure, Spectroscopic Properties, and Reactivity of Molybdenum and Tungsten Nitrido and Imido Complexes with Diphosphine Coligands:  Influence of the trans Ligand†

Klaus Mersmann; Andreas Hauser; Nicolai Lehnert; Felix Tuczek

doi:10.1021/ic060141n

Electronic Structure, Spectroscopic Properties, and Reactivity of Molybdenum and Tungsten Nitrido and Imido Complexes with Diphosphine Coligands: Influence of the trans Ligand†

Inorganic Chemistry ◽

10.1021/ic060141n ◽

2006 ◽

Vol 45 (13) ◽

pp. 5044-5056 ◽

Cited By ~ 21

Author(s):

Klaus Mersmann ◽

Andreas Hauser ◽

Nicolai Lehnert ◽

Felix Tuczek

Keyword(s):

Electronic Structure ◽

Spectroscopic Properties ◽

Imido Complexes ◽

And Tungsten

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ELECTRONIC STRUCTURE AND SPECTROSCOPIC PROPERTIES OF MOLYBDENUM AND TUNGSTEN N2, NNH, NNH2, AND NNH3 COMPLEXES WITH DIPHOSPHINE CO-LIGANDS: INSIGHTS INTO THE END-ON TERMINAL REDUCTION PATHWAY OF DINITROGEN

Advances in Inorganic Chemistry ◽

10.1016/s0898-8838(04)56002-6 ◽

2004 ◽

pp. 27-53 ◽

Cited By ~ 16

Author(s):

FELIX TUCZEK

Keyword(s):

Electronic Structure ◽

Spectroscopic Properties ◽

And Tungsten

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Electronic structure modulation of nickel hydroxide and tungsten nanoparticles for fast structure transformation and enhanced Oxygen Evolution Reaction activity

Chemical Engineering Journal ◽

10.1016/j.cej.2021.129403 ◽

2021 ◽

pp. 129403

Author(s):

Taeoh Kang ◽

Kwanwoo Kim ◽

Myeongjin Kim ◽

Jooheon Kim

Keyword(s):

Electronic Structure ◽

Oxygen Evolution ◽

Nickel Hydroxide ◽

Oxygen Evolution Reaction ◽

Structure Transformation ◽

Structure Modulation ◽

Tungsten Nanoparticles ◽

And Tungsten

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Imido complexes of molybdenum and tungsten(VI); X-ray crystal structure of cis-(η1-CF3SO3)2 W(NBut)2(NH2But)2

Polyhedron ◽

10.1016/s0277-5387(00)86297-x ◽

1989 ◽

Vol 8 (24) ◽

pp. 2947-2949 ◽

Cited By ~ 15

Author(s):

Andreas A. Danopoulos ◽

Geoffrey Wilkinson ◽

Michael B. Hursthouse ◽

Bilquis Hussain

Keyword(s):

Crystal Structure ◽

X Ray ◽

Imido Complexes ◽

And Tungsten

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Electronic structure and spectroscopic properties of copper catecholate complexes with interligand charge-transfer behavior

Inorganica Chimica Acta ◽

10.1016/s0020-1693(00)82924-2 ◽

1993 ◽

Vol 204 (2) ◽

pp. 189-193 ◽

Cited By ~ 15

Author(s):

Roland Benedix ◽

Arnd Vogler

Keyword(s):

Electronic Structure ◽

Charge Transfer ◽

Spectroscopic Properties ◽

Transfer Behavior

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Fe-N-C Catalysts for Oxygen Reduction Reaction: A Computational Analysis of Electronic Structure and Spectroscopic Properties

ECS Meeting Abstracts ◽

10.1149/ma2021-02391139mtgabs ◽

2021 ◽

Vol MA2021-02 (39) ◽

pp. 1139-1139

Author(s):

Charlotte Gallenkamp ◽

Lingmei Ni ◽

Vera Krewald ◽

Ulrike I. Kramm

Keyword(s):

Electronic Structure ◽

Oxygen Reduction Reaction ◽

Oxygen Reduction ◽

Computational Analysis ◽

Spectroscopic Properties ◽

Reduction Reaction

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Substituent Effect on the Electronic Structure and UV/Vis. Spectroscopic Properties of Polyacetylene Oligomers for Photovoltaic Devices: DFT and TD-DFT based investigations

Materials Today Proceedings ◽

10.1016/j.matpr.2021.08.166 ◽

2021 ◽

Vol 47 ◽

pp. 6359-6363

Author(s):

Pallavi V. Rathod ◽

Reshma S. Pingale ◽

Anjali Kshirsagar ◽

Subhash S. Pingale

Keyword(s):

Electronic Structure ◽

Substituent Effect ◽

Spectroscopic Properties ◽

Photovoltaic Devices ◽

Td Dft

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Electronic structure, topological analysis and spectroscopic properties of sandwich indenyl complexes of ruthenium: A theoretical study

Journal of Molecular Structure ◽

10.1016/j.molstruc.2019.04.030 ◽

2019 ◽

Vol 1189 ◽

pp. 219-224

Author(s):

Souhila Laib ◽

Wahiba Boussebbat

Keyword(s):

Electronic Structure ◽

Theoretical Study ◽

Topological Analysis ◽

Spectroscopic Properties ◽

Indenyl Complexes

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Theoretical Study of the Electronic Structure and Spectroscopic Properties of a New Diatomic Molecule: BeB

The Journal of Physical Chemistry ◽

10.1021/j100099a019 ◽

1994 ◽

Vol 98 (48) ◽

pp. 12570-12578 ◽

Cited By ~ 35

Author(s):

Fernando R. Ornellas ◽

Anna Regina S. Valentim

Keyword(s):

Electronic Structure ◽

Diatomic Molecule ◽

Theoretical Study ◽

Spectroscopic Properties

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Electronic structure and electronic absorption spectra of molybdenum and tungsten oxotetrachlorides

Theoretica Chimica Acta ◽

10.1007/bf00552593 ◽

1980 ◽

Vol 56 (4) ◽

pp. 297-306 ◽

Cited By ~ 10

Author(s):

Igor A. Topol ◽

Nikolaj F. Stepanov ◽

Vasilij M. Kovba

Keyword(s):

Electronic Structure ◽

Absorption Spectra ◽

Electronic Absorption ◽

Electronic Absorption Spectra ◽

And Tungsten

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Investigation of the Electronic Structure and Optical, EPR, and ODMR Spectroscopic Properties for 171Yb3+-Doped Y2SiO5 Crystal: A Combined Theoretical Approach

Inorganic Chemistry ◽

10.1021/acs.inorgchem.0c01430 ◽

2020 ◽

Vol 59 (18) ◽

pp. 13144-13152

Author(s):

Xiaonan Zhou ◽

Honggang Liu ◽

Zhiyu He ◽

Baojun Chen ◽

Jun Wu

Keyword(s):

Electronic Structure ◽

Theoretical Approach ◽

Spectroscopic Properties

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