Theoretical investigation of electronic structures and excitation energies of doubly N-confused porphyrin and its group 11 transition metal (III) complexes

Yulan Zhu; Shuyu Zhou; Yuhe Kan; Likai Yan; Zhongmin Su

doi:10.1063/1.2749513

Theoretical investigation of electronic structures and excitation energies of doubly N-confused porphyrin and its group 11 transition metal (III) complexes

The Journal of Chemical Physics ◽

10.1063/1.2749513 ◽

2007 ◽

Vol 126 (24) ◽

pp. 245106 ◽

Cited By ~ 8

Author(s):

Yulan Zhu ◽

Shuyu Zhou ◽

Yuhe Kan ◽

Likai Yan ◽

Zhongmin Su

Keyword(s):

Transition Metal ◽

Theoretical Investigation ◽

Electronic Structures ◽

Excitation Energies

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Theoretical investigation of electronic structures and excitation energies of hexaphyrin and its group 11 transition metal (III) complexes

Journal of Organometallic Chemistry ◽

10.1016/j.jorganchem.2009.05.002 ◽

2009 ◽

Vol 694 (18) ◽

pp. 3012-3018 ◽

Cited By ~ 5

Author(s):

Yu-Lan Zhu ◽

Shu-Yu Zhou ◽

Yu-He Kan ◽

Zhong-Min Su

Keyword(s):

Transition Metal ◽

Theoretical Investigation ◽

Electronic Structures ◽

Excitation Energies

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Theoretical investigation of the molecular, electronic structures and vibrational spectra of a series of first transition metal phthalocyanines

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2006.10.013 ◽

2007 ◽

Vol 67 (5) ◽

pp. 1232-1246 ◽

Cited By ~ 106

Author(s):

Zhongqiang Liu ◽

Xianxi Zhang ◽

Yuexing Zhang ◽

Jianzhuang Jiang

Keyword(s):

Transition Metal ◽

Theoretical Investigation ◽

Vibrational Spectra ◽

Electronic Structures ◽

Molecular Electronic ◽

Metal Phthalocyanines

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Theoretical investigation of the molecular, electronic structures and vibrational spectra of a series of first transition metal phthalocyanines by Z. Liu et al.

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2008.02.033 ◽

2008 ◽

Vol 71 (1) ◽

pp. 286-287 ◽

Cited By ~ 16

Author(s):

Michinori Sumimoto ◽

Yukio Kawashima ◽

Kenzi Hori ◽

Hitoshi Fujimoto

Keyword(s):

Transition Metal ◽

Theoretical Investigation ◽

Vibrational Spectra ◽

Electronic Structures ◽

Molecular Electronic ◽

Metal Phthalocyanines

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Paramagnetic NMR Spectroscopy as a Tool for Studying the Electronic Structures of Lanthanide and Transition Metal Complexes

INEOS OPEN ◽

10.32931/io1922r ◽

2020 ◽

Vol 2 (5) ◽

pp. 153-162

Author(s):

A. A. Pavlov ◽

Keyword(s):

Nmr Spectroscopy ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Electronic Structures ◽

Paramagnetic Nmr

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Exchange Coupling of Transition-Metal Ions through Hydrogen Bonding: A Theoretical Investigation

Journal of the American Chemical Society ◽

10.1021/ja0178160 ◽

2002 ◽

Vol 124 (18) ◽

pp. 5197-5205 ◽

Cited By ~ 154

Author(s):

Cédric Desplanches ◽

Eliseo Ruiz ◽

Antonio Rodríguez-Fortea ◽

Santiago Alvarez

Keyword(s):

Hydrogen Bonding ◽

Transition Metal ◽

Metal Ions ◽

Theoretical Investigation ◽

Exchange Coupling ◽

Transition Metal Ions

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Stabilities, Electronic Structures, and Bonding Properties of 20-Electron Transition Metal Complexes (Cp)2TMO and their One-Dimensional Sandwich Molecular Wires (Cp = C5H5, C5(CH3)H4, C5(CH3)5; TM = Cr, Mo, W)

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.0c07402 ◽

2021 ◽

Vol 125 (3) ◽

pp. 721-730

Author(s):

Song Xu ◽

Mengyang Li ◽

Gerui Pei ◽

Pei Zhao ◽

Xintian Zhao ◽

...

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Electronic Structures ◽

Electron Transition ◽

Molecular Wires ◽

One Dimensional ◽

Bonding Properties

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Cleaving plane-dependent electronic structures of transition metal diarsenides

Physical Review Research ◽

10.1103/physrevresearch.3.023170 ◽

2021 ◽

Vol 3 (2) ◽

Author(s):

Gyanendra Dhakal ◽

M. Mofazzel Hosen ◽

Wei-Chi Chiu ◽

Bahadur Singh ◽

Cheng-Yi Huang ◽

...

Keyword(s):

Transition Metal ◽

Electronic Structures

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ChemInform Abstract: MOLECULAR AND ELECTRONIC STRUCTURES OF TRANSITION METAL TRIFLUORIDES

Chemischer Informationsdienst ◽

10.1002/chin.197934005 ◽

1979 ◽

Vol 10 (34) ◽

Author(s):

J. H. YATES ◽

R. M. PITZER

Keyword(s):

Transition Metal ◽

Electronic Structures

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Transition metal complexes of a tridentate biquinone ligand: electronic structures, charge distributions and magnetic properties

Inorganica Chimica Acta ◽

10.1016/0020-1693(94)04245-q ◽

1995 ◽

Vol 229 (1-2) ◽

pp. 195-202 ◽

Cited By ~ 10

Author(s):

Tong Ren

Keyword(s):

Magnetic Properties ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Electronic Structures ◽

Charge Distributions

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Comparative Theoretical Investigation of the Vertical Excitation Energies and the Electronic Structure of [MoVOCl4]-: Influence of Basis Set and Geometry

Inorganic Chemistry ◽

10.1021/ic0262942 ◽

2003 ◽

Vol 42 (13) ◽

pp. 4046-4056 ◽

Cited By ~ 28

Author(s):

Victor N. Nemykin ◽

Partha Basu

Keyword(s):

Electronic Structure ◽

Theoretical Investigation ◽

Basis Set ◽

Excitation Energies ◽

Vertical Excitation ◽

Vertical Excitation Energies

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