Excited electronic states from a variational approach based on symmetry-projected Hartree–Fock configurations

Carlos A. Jiménez-Hoyos; R. Rodríguez-Guzmán; Gustavo E. Scuseria

doi:10.1063/1.4840097

Excited electronic states from a variational approach based on symmetry-projected Hartree–Fock configurations

The Journal of Chemical Physics ◽

10.1063/1.4840097 ◽

2013 ◽

Vol 139 (22) ◽

pp. 224110 ◽

Cited By ~ 25

Author(s):

Carlos A. Jiménez-Hoyos ◽

R. Rodríguez-Guzmán ◽

Gustavo E. Scuseria

Keyword(s):

Variational Approach ◽

Electronic States ◽

Excited Electronic States ◽

Hartree Fock

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Excited electronic states of alternant .pi.-electron systems from projected Unrestricted Hartree-Fock theory

The Journal of Physical Chemistry ◽

10.1021/j100517a014 ◽

1977 ◽

Vol 81 (2) ◽

pp. 167-171 ◽

Cited By ~ 5

Author(s):

John C. Schug ◽

Dana A. Brewer

Keyword(s):

Electronic States ◽

Electron Systems ◽

Excited Electronic States ◽

Hartree Fock

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Scaled Hartree-Fock orbitals for perturbation treatment of ground and excited electronic states

Physical Review A ◽

10.1103/physreva.38.6059 ◽

1988 ◽

Vol 38 (12) ◽

pp. 6059-6065 ◽

Cited By ~ 5

Author(s):

R. Sawatzki ◽

L. S. Cederbaum

Keyword(s):

Electronic States ◽

Excited Electronic States ◽

Hartree Fock

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A multiconfigurational time-dependent Hartree-Fock method for excited electronic states. I. General formalism and application to open-shell states

The Journal of Chemical Physics ◽

10.1063/1.3600397 ◽

2011 ◽

Vol 134 (24) ◽

pp. 244101 ◽

Cited By ~ 41

Author(s):

R. P. Miranda ◽

A. J. Fisher ◽

L. Stella ◽

A. P. Horsfield

Keyword(s):

Electronic States ◽

Open Shell ◽

Time Dependent ◽

Excited Electronic States ◽

Hartree Fock

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Orthogonality of determinant functions in the Hartree-Fock method for highly excited electronic states

Optics and Spectroscopy ◽

10.1134/s0030400x15070115 ◽

2015 ◽

Vol 119 (1) ◽

pp. 1-6 ◽

Cited By ~ 5

Author(s):

V. N. Glushkov

Keyword(s):

Electronic States ◽

Excited Electronic States ◽

Hartree Fock

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A multiconfigurational time-dependent Hartree-Fock method for excited electronic states. II. Coulomb interaction effects in single conjugated polymer chains

The Journal of Chemical Physics ◽

10.1063/1.3600404 ◽

2011 ◽

Vol 134 (24) ◽

pp. 244102 ◽

Cited By ~ 16

Author(s):

R. P. Miranda ◽

A. J. Fisher ◽

L. Stella ◽

A. P. Horsfield

Keyword(s):

Coulomb Interaction ◽

Conjugated Polymer ◽

Electronic States ◽

Interaction Effects ◽

Polymer Chains ◽

Time Dependent ◽

Excited Electronic States ◽

Hartree Fock ◽

Conjugated Polymer Chains

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REACTION KINETICS OF CO AND CH4 MOLECULES WITH O2 IN EXCITED ELECTRONIC STATES: QUANTUM CHEMICAL STUDY

8th International Symposium on Nonequilibrium Processes, Plasma, Combustion, and Atmospheric Phenomena held Том. Volum 1. Kinetics and plasma ◽

10.30826/nepcap2018-1-03 ◽

2018 ◽

Author(s):

A. S SHARIPOV ◽

◽

A. V. PELEVKIN ◽

Keyword(s):

Reaction Kinetics ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Electronic States ◽

Chemical Study ◽

Excited Electronic States ◽

Kinetics Of

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An Initio Studies of Ground and Excited Electronic States of MgAr, CdAr, and BeAr

10.21236/ada239248 ◽

1991 ◽

Author(s):

Jerry A. Boatz ◽

Keld L. Bak ◽

Jack Simons

Keyword(s):

Electronic States ◽

Excited Electronic States

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Reactions of ions in excited electronic states: (CO+⋅) *+CO→C2O+⋅+CO

The Journal of Chemical Physics ◽

10.1063/1.431760 ◽

1975 ◽

Vol 63 (8) ◽

pp. 3656-3660 ◽

Cited By ~ 12

Author(s):

Michael T. Bowers ◽

Marian Chau ◽

Paul R. Kemper

Keyword(s):

Electronic States ◽

Excited Electronic States

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The electronic spectrum of s‐tetrazine: Structures and vibrational frequencies of the ground and excited electronic states

The Journal of Chemical Physics ◽

10.1063/1.452999 ◽

1987 ◽

Vol 87 (6) ◽

pp. 3539-3556 ◽

Cited By ~ 24

Author(s):

Andrew C. Scheiner ◽

Henry F. Schaefer

Keyword(s):

Electronic Spectrum ◽

Electronic States ◽

Vibrational Frequencies ◽

Excited Electronic States

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Comments on the paper “Modulation of period of quantum beats from optical emissions from the excited electronic states of mercury triatomic clusters” by E. Sarantopoulou, et al. (Eds.) [Synth. Met. 124 (2001) 267]

Synthetic Metals ◽

10.1016/j.synthmet.2003.10.019 ◽

2004 ◽

Vol 140 (2-3) ◽

pp. 109-111

Author(s):

M. Kompitsas

Keyword(s):

Electronic States ◽

Quantum Beats ◽

Excited Electronic States ◽

Optical Emissions

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