Electronic structure of mixed-valence ions: ESCA and MO calculations on [.eta.5-C5H5Fe(CO)]2-.mu.-Ph2P(CH2)nPPh2m+, (n = 1, 2); (m = 0, 1)

David E. Sherwood; Michael B. Hall

doi:10.1021/ic50190a020

Electronic structure of mixed-valence ions: ESCA and MO calculations on [.eta.5-C5H5Fe(CO)]2-.mu.-Ph2P(CH2)nPPh2m+, (n = 1, 2); (m = 0, 1)

Inorganic Chemistry ◽

10.1021/ic50190a020 ◽

1978 ◽

Vol 17 (12) ◽

pp. 3397-3401 ◽

Cited By ~ 10

Author(s):

David E. Sherwood ◽

Michael B. Hall

Keyword(s):

Electronic Structure ◽

Mixed Valence ◽

Mo Calculations

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ChemInform Abstract: ELECTRONIC STRUCTURE OF MIXED-VALENCE IONS- ESCA AND MO CALCULATIONS ON (η5-C5H5FE(CO))2-μ-PH2P(CH2)NPPH2M+, (N = 1, 2), (M = 0, 1)

Chemischer Informationsdienst ◽

10.1002/chin.197910052 ◽

1979 ◽

Vol 10 (10) ◽

Author(s):

D. E. JUN. SHERWOOD ◽

M. B. HALL

Keyword(s):

Electronic Structure ◽

Mixed Valence ◽

Mo Calculations

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Comment on “Pressure-induced structural and valence transition in AgO” by C. Hou, J. Botana, X. Zhang, X. Wang and M. Miao, Phys. Chem. Chem. Phys., 2016, 18, 15322

Physical Chemistry Chemical Physics ◽

10.1039/c6cp04144b ◽

2016 ◽

Vol 18 (46) ◽

pp. 31973-31974 ◽

Cited By ~ 1

Author(s):

Mariana Derzsi ◽

Wojciech Grochala

Keyword(s):

Electronic Structure ◽

Synthesis, structure determination, and electronic structure characterization of two mixed-valence tetranuclear platinum blues with bridging .alpha.-pyridonate or 1-methyluracilate ligands

Inorganic Chemistry ◽

10.1021/ic00255a016 ◽

1987 ◽

Vol 26 (8) ◽

pp. 1261-1270 ◽

Cited By ~ 55

Author(s):

Thomas V. O'Halloran ◽

Pradip K. Mascharak ◽

Ian D. Williams ◽

Michael M. Roberts ◽

Stephen J. Lippard

Keyword(s):

Electronic Structure ◽

Structure Determination ◽

Mixed Valence ◽

Structure Characterization

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Electronic transfer dynamics for bridged binuclear mixed-valence compounds: Density functional theory study on electronic structure in the ground state for the Creutz–Taube ion under asymmetric distortions

The Journal of Chemical Physics ◽

10.1063/1.480456 ◽

1999 ◽

Vol 111 (24) ◽

pp. 10926-10933 ◽

Cited By ~ 4

Author(s):

Zhida Chen ◽

Jiang Bian ◽

Lei Zhang ◽

Shuzhou Li

Keyword(s):

Density Functional Theory ◽

Electronic Structure ◽

Ground State ◽

Density Functional ◽

Mixed Valence ◽

Density Functional Theory Study ◽

Functional Theory ◽

Electronic Transfer ◽

Mixed Valence Compounds

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ChemInform Abstract: ELECTRONIC STRUCTURE IN THE INTERVALENCE TRANSFER ABSORPTION BAND OF A MIXED-VALENCE DIMER

Chemischer Informationsdienst ◽

10.1002/chin.198340069 ◽

1983 ◽

Vol 14 (40) ◽

Author(s):

E. M. KOBER ◽

K. A. GOLDSBY ◽

D. N. S. NARAYANA ◽

T. J. MEYER

Keyword(s):

Electronic Structure ◽

Absorption Band ◽

Mixed Valence

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IR Sensing of the Electronic Structure in the Mixed-Valence States of Iron Carbonyl-Attached Biferrocene and Terferrocene

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.71.1817 ◽

1998 ◽

Vol 71 (8) ◽

pp. 1817-1823 ◽

Cited By ~ 9

Author(s):

Takashi Hirao ◽

Kunitsugu Aramaki ◽

Hiroshi Nishihara

Keyword(s):

Electronic Structure ◽

Mixed Valence ◽

Iron Carbonyl ◽

Valence States

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Variable electronegativitySCF-MO calculations on the electronic structure and spectra of some substituted benzenes I. Monosubstitutions

International Journal of Quantum Chemistry ◽

10.1002/qua.560060104 ◽

1972 ◽

Vol 6 (1) ◽

pp. 47-55 ◽

Cited By ~ 18

Author(s):

P. C. Mishra ◽

D. K. Rai

Keyword(s):

Electronic Structure ◽

Mo Calculations ◽

Substituted Benzenes

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Mixed-Valence Cyanopyridine-Bridged Complexes of Pentacyanoferrate and Pentaammineruthenium: Electronic Structure, Stability, and Redox Reactivity

Inorganic Chemistry ◽

10.1021/ic960489q ◽

1996 ◽

Vol 35 (26) ◽

pp. 7718-7727 ◽

Cited By ~ 19

Author(s):

Alejandra E. Almaraz ◽

Luis A. Gentil ◽

Luis M. Baraldo ◽

José A. Olabe

Keyword(s):

Electronic Structure ◽

Mixed Valence ◽

Structure Stability ◽

Redox Reactivity

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Electronic structure and thermodynamic properties of dimeric mixed-valence clusters

Theoretical and Experimental Chemistry ◽

10.1007/bf00534573 ◽

1987 ◽

Vol 23 (2) ◽

pp. 141-149

Author(s):

M. I. Belinskii ◽

B. S. Tsukerblat ◽

I. G. Botsan ◽

I. S. Belinskaya

Keyword(s):

Electronic Structure ◽

Thermodynamic Properties ◽

Mixed Valence

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Cluster MO Calculations of Electronic Structure and X-Ray Emission Spectra of Carbide Alloys TixV1−xC

physica status solidi (b) ◽

10.1002/pssb.2220980106 ◽

1980 ◽

Vol 98 (1) ◽

pp. 79-86 ◽

Cited By ~ 12

Author(s):

A. L. Ivanovskii ◽

V. A. Gubanov ◽

V. P. Zhukov ◽

G. P. Shveikin

Keyword(s):

Electronic Structure ◽

Emission Spectra ◽

Mo Calculations ◽

X Ray

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