Proof and discussion of the upper‐bound principle for excited‐state wave functions obtained by the linear variation method

American Journal of Physics ◽

10.1119/1.17591 ◽

1994 ◽

Vol 62 (2) ◽

pp. 184-186 ◽

Author(s):

Jonathan E. Kenny

Keyword(s):

Excited State ◽

Upper Bound ◽

Wave Functions ◽

Variation Method ◽

Linear Variation ◽

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Two-program package to calculate the ground and excited state wave functions in the Hartree—Fock—Dirac approximation

Computer Physics Communications ◽

10.1016/s0010-4655(98)00197-0 ◽

1999 ◽

Vol 119 (2-3) ◽

pp. 232-255 ◽

Author(s):

L.V. Chernysheva ◽

V.L. Yakhontov

Keyword(s):

Excited State ◽

Wave Functions ◽

Program Package ◽

Hartree Fock ◽

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Optimization of Ground- and Excited-State Wave Functions and van der Waals Clusters

Physical Review Letters ◽

10.1103/physrevlett.87.043401 ◽

2001 ◽

Vol 87 (4) ◽

Author(s):

M. P. Nightingale ◽

Vilen Melik-Alaverdian

Keyword(s):

Excited State ◽

Van Der Waals ◽

Wave Functions ◽

Van Der Waals Clusters ◽

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Excited state wave functions

Theoretica Chimica Acta ◽

10.1007/bf00528318 ◽

1972 ◽

Vol 24 (1) ◽

pp. 111-116 ◽

Author(s):

A. C. Brett ◽

T. W. Dingle

Keyword(s):

Excited State ◽

Wave Functions ◽

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A Simple Algorithm for Determining Orthogonal, Self-Consistent Excited-State Wave Functions for a State-Specific Hamiltonian: Application to the Optical Spectrum of the Aqueous Electron

Journal of Chemical Theory and Computation ◽

10.1021/ct200265t ◽

2011 ◽

Vol 7 (7) ◽

pp. 2085-2093 ◽

Author(s):

Leif D. Jacobson ◽

John M. Herbert

Keyword(s):

Excited State ◽

Optical Spectrum ◽

Simple Algorithm ◽

Wave Functions ◽

Self Consistent

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Nucleon excited state wave functions from lattice QCD

Physical Review D ◽

10.1103/physrevd.89.074501 ◽

2014 ◽

Vol 89 (7) ◽

Author(s):

Dale S. Roberts ◽

Waseem Kamleh ◽

Derek B. Leinweber

Keyword(s):

Excited State ◽

Lattice Qcd ◽

Wave Functions ◽

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Theory and calculation of excited-state wave functions and properties

International Journal of Quantum Chemistry ◽

10.1002/qua.560100812 ◽

2009 ◽

Vol 10 (S10) ◽

pp. 119-134 ◽

Author(s):

Donald R. Beck ◽

Cleanthes A. Nicolaides

Keyword(s):

Excited State ◽

Wave Functions ◽

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Correct small-truncated excited state wave functions obtained via minimization principle for excited states compared/ opposed to Hylleraas-Undheim and McDonald higher ``roots''

Journal of Computational Methods in Sciences and Engineering ◽

10.3233/jcm-170722 ◽

2017 ◽

Vol 17 (3) ◽

pp. 347-361

Author(s):

Z. Xiong ◽

J. Zang ◽

H.J. Liu ◽

D. Karaoulanis ◽

Q. Zhou ◽

...

Keyword(s):

Excited State ◽

Excited States ◽

Wave Functions ◽

Minimization Principle ◽

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A semiempirical effective Hamiltonian based approach for analyzing excited state wave functions and computing excited state absorption spectra using real-time dynamics

The Journal of Chemical Physics ◽

10.1063/1.5061746 ◽

2019 ◽

Vol 150 (10) ◽

pp. 104103 ◽

Author(s):

Soumen Ghosh ◽

Jason C. Asher ◽

Laura Gagliardi ◽

Christopher J. Cramer ◽

Niranjan Govind

Keyword(s):

Excited State ◽

Real Time ◽

Absorption Spectra ◽

Excited State Absorption ◽

Wave Functions ◽

Effective Hamiltonian ◽

Time Dynamics ◽

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Comment on “Optimization of Ground- and Excited-State Wave Functions and van der Waals Clusters”

Physical Review Letters ◽

10.1103/physrevlett.98.119301 ◽

2007 ◽

Vol 98 (11) ◽

Author(s):

X.-G. Wang ◽

T. Carrington

Keyword(s):

Excited State ◽

Van Der Waals ◽

Wave Functions ◽

Van Der Waals Clusters ◽

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On a variational method for determining excited state wave functions

Theoretica Chimica Acta ◽

10.1007/bf00527113 ◽

1969 ◽

Vol 14 (4) ◽

pp. 319-328 ◽

Author(s):

Richard P. Messmer

Keyword(s):

Excited State ◽

Variational Method ◽

Wave Functions ◽

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