Electronic structure, vibrational spectrum and photochemistry of the Fe+H2 system (original) (raw)
Vibrational Spectroscopy of Fe3(+)(CH4)n (n=1-3) and Fe4(+)(CH4)4
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The journal of physical chemistry. A, 2017
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2018
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Gabriel Aullón
Organometallics, 2001
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Torsten Wende, Daniel Boese
The Journal of Chemical Physics, 2014
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manuel bautista
The Astrophysical Journal, 2015
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The Hei and HeH Photoelectron Spectra of [Fe*?3-C3H5(CO)3X] and [Fe^3-C4H7 (CO)3X] (X = Cl, Br, I) and [CoC3H5(CO)3]
Jaap Louwen
Zeitschrift für Naturforschung B, 1982
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On the photofragmentation of Fe(CO)5. II. Molecular orbital studies of Fe(CO)n, 1≥n≥5
Marco Aurelio De Paoli
The Journal of Chemical Physics, 1984
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HYPERFINE INTERACTION OF THE Fe 2+ ION IN Fe(H 2 O) 6 ·(ClO 4 ) 2
Denes Lajos Nagy
Le Journal de Physique Colloques, 1974
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You-Jun Fu
The Journal of Physical Chemistry A, 2003
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Interplay of Intra-atomic and Interatomic Effects: An Investigation of the2pCore Level Spectra of Atomic Fe and MolecularFeCl2
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FURTHER EXAMPLES OF A LIGAND FIELD CALCULATION FOR THE SIXFOLD COORDINATED COMPLEX Fe(H2O)2+6
Denes Lajos Nagy
Le Journal de Physique Colloques, 1976
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1 H-ENDOR Evidence for a Hydrogen-Bonding Interaction That Modulates the Reactivity of a Nonheme Fe IV ═O Unit
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The electronic configuration of Fe in
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Journal of Physics: Condensed Matter, 1997
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A theoretical study of the reaction of Fe+ (6D) with H2
A. Oliva
Journal of Molecular Structure: THEOCHEM, 1988
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Solvent Effects on Molecular and Ionic Spectra. 4. Photochemistry of Fe2+(H2O)6 in Water Revisited: Possible Mechanisms for the Primary Absorption Process Leading to Electron Ejection
Jeffrey Reimers
The Journal of Physical Chemistry, 1994
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Time-Dependent Density Functional Theory Study of Fe 2 (CO) 9 Low-Lying Electronic Excited States
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Journal of Physical Chemistry A, 2006
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Electronic structures and rovibronically averaged geometries of the X̃ [sup 6]A[sub i][sup ʹ] and à [sup 6]A[sub i][sup ʺ] states of FeOH
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The Journal of Chemical Physics, 2010
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The low-lying electronic states of FeO+: Rotational analysis of the resonance enhanced photodissociation spectra of the 6Π7/2←X 6Σ+ system
FERNANDO VELAZQUEZ AGUIRRE
The Journal of Chemical Physics, 2003
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Theoretical Investigation of the Electronic Structure of Fe(II) Complexes at Spin-State Transitions
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2015
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Electronic structure of compounds with Fe-C bonds
Maurizio Persico
Journal of Molecular Structure: THEOCHEM, 1993
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The Photochemistry of Fe2(S2C3H6)(CO)6(µ-CO) and Its Oxidized Form, Two Simple [FeFe]-Hydrogenase CO-Inhibited Models. A DFT and TDDFT Investigation
Luca Bertini
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Redox and Structural Properties of Mixed-Valence Models for the Active Site of the [FeFe]-Hydrogenase: Progress and Challenges
Scott Wilson
Inorganic Chemistry, 2008
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Low-lying states and electronic spectroscopy of iron(II) prophine
Brian Weiner
Journal of The American Chemical Society, 1986
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Inner-shell photoexcitation of Fe xv and Fe xvi
Gary Ferland
Monthly Notices of the Royal Astronomical Society, 2003
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Comment on "Fe2: As simple as a Herculean labour. Neutral (Fe2), cationic (Fe2 (+)), and anionic (Fe2 (-)) species" [J. Chem. Phys. 142, 244304 (2015)]
Donald Truhlar
The Journal of chemical physics, 2016
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Fe(N 2 ) n ( n = 1−5): Structure, Bonding, and Vibrations from Density Functional Theory
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