Angle-resolved photoelectron spectra of ethylene as a function of photon energy using synchrotron radiation
Thomas J.s Carlson
Journal of Electron Spectroscopy and Related Phenomena, 1982
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Calculation of Franck–Condon factors including anharmonicity: Simulation of the C2H4+X̃B3u2←C2H4X̃Ag1 band in the photoelectron spectrum of ethylene
Bernard Kirtman
Journal of Chemical Physics, 2005
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Calculation of Franck-Condon factors including anharmonicity: simulation of the C2 H4+ X̃2B 3u← C2 H4X̃1 Ag band in the photoelectron spectrum of ethylene
Josep Maria Luis Luis, Miquel Solà, Bernard Kirtman
… Journal of Chemical …, 2005
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Calculation of Franck–Condon factors including anharmonicity: Simulation of the C[sub 2]H[sub 4]+]X̃ [sup 2]B[sub 3u]←C[sub 2]H[sub 4]X̃ [sup 1]A[sub g] band in the photoelectron spectrum of ethylene
Miquel Solà
The Journal of Chemical Physics, 2005
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Inner and valence shell photoelectron spectra calculated by the density functional method
Gianfranco Rovida
Journal of Electron Spectroscopy and Related Phenomena, 1994
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Application of time-dependent density-functional theory to electron-ion couplng in ethylene
Jeffrey Giansiracusa
Israel Journal of Chemistry, 2002
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Valence and ionic lowest-lying electronic states of ethyl formate as studied by high-resolution vacuum ultraviolet photoabsorption, He(I) photoelectron spectroscopy, and ab initio calculations
Jacques DELWICHE
The Journal of chemical physics, 2014
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Photoelectron spectra of molecules. Part 12. Vinyl, allyl, and phenyl ethers and sulphides
Ilmar Koppel
2002
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Anharmonic vibrational state calculations in the electronic excited states studied by time-dependent density functional theory
Kimihiko Hirao
Chemical Physics Letters, 2007
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Nonempirical Calculations on Excited States: The Ethylene Molecule
Thom Dunning
The Journal of Chemical Physics, 1967
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Ab Initio Calculations on 1,3,5-Trimethylenebenzene and Its Negative Ion Provide Predictions about the Photoelectron Spectrum of the Ion
Weston Borden
Journal of the American Chemical Society, 1997
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Modelling the effect of nuclear motion on the attosecond time-resolved photoelectron spectra of ethylene
Duncan Mowbray
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Modeling Photoelectron Spectra of Conjugated Oligomers with Time-Dependent Density Functional Theory
Ulrike Salzner
The Journal of Physical Chemistry A, 2010
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sigma. and .pi. Electronic structures in the ground, triplet, and ionic states of ethylene
stephen rothenberg
Journal of the American Chemical Society, 1970
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Photoelectron Spectra of Some Important Biological Molecules: Symmetry-Adapted-Cluster Configuration Interaction Study
Hossein farrokhpour
The Journal of Physical Chemistry B, 2013
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Photochemistry of ethylene: A multireference configuration interaction investigation of the excited-state energy surfaces
Mario Barbatti, Joachim Paier
2004
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Franck–Condon analysis of photoelectron and electronic spectra of small molecules
John Dyke
Journal of Electron Spectroscopy and Related Phenomena, 1998
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Application of the MC SCF method to the π → π* excitation energies of ethylene
Kenneth D. Jordan
Chemical Physics, 1984
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An experimental and theoretical study of the valence shell photoelectron spectrum of tetrafluoromethane
L. Karlsson
Chemical Physics, 2005
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Ionization Potential, Electron Affinity, Electronegativity, Hardness, and Electron Excitation Energy: Molecular Properties from Density Functional Theory Orbital Energies
David Dixon
The Journal of Physical Chemistry A, 2003
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Continuum resonance in ethylene: Evidence from vibrationally resolved core photoionization
S. Svensson
Physical Review A, 1998
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A photoelectron spectroscopy study of the valence shell photoionization dynamics of acetylene
L. Karlsson
Journal of Electron Spectroscopy and Related Phenomena, 1998
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Simulation of photoelectron and electronic spectra of small molecules
John Dyke
Journal of Electron …, 2000
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Multi-electron excitation contributions towards primary and satellite states in the photoelectron spectrum
Torsha Moitra
2021
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The ground and ionized states of azulene: A combined study of the vibrational energy levels by photoionization, configuration interaction, and density functional calculations
monica de simone
The Journal of Chemical Physics, 2022
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Ab initio angle- and energy-resolved photoelectron spectroscopy with time-dependent density-functional theory
Daniele Varsano, A. Rubio
Physical Review A, 2012
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Theoretical investigations of free radicals and negative molecular ions and their calculated photoelectron spectra
Stefan Schmatz
Journal of Electron Spectroscopy and Related Phenomena, 2000
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Photoelectron spectroscopic study of the first singlet and triplet states of the cyclopentadienyl cation
Hans Wörner
Angewandte Chemie (International ed. in English), 2005
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Photoionization of ethylene clusters
S Ceyer
The Journal of Chemical Physics, 1979
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Theoretical study on the electronic and molecular properties of ground and excited states of ethylenedioxythiophene and styrenesulphonic acid
Chen Lv
Applied Surface Science, 2005
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Electronic states of organic molecules. 3. Photoelectron spectra of cycloalkenes and methylenecycloalkanes
Kenneth Wiberg
Journal of the American Chemical Society, 1976
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A new accurate ground-state potential energy surface of ethylene and predictions for rotational and vibrational energy levels
Vladimir Tyuterev
The Journal of chemical physics, 2014
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Ab initio molecular dynamics with equation-of-motion coupled-cluster theory: electronic absorption spectrum of ethylene
Todd Martinez
Chemical Physics Letters, 2003
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