scholarly journals Canonical-basis time-dependent Hartree-Fock-Bogoliubov theory and linear-response calculations

2010 ◽  
Vol 82 (3) ◽  
Author(s):  
Shuichiro Ebata ◽  
Takashi Nakatsukasa ◽  
Tsunenori Inakura ◽  
Kenichi Yoshida ◽  
Yukio Hashimoto ◽  
...  
Keyword(s):  
Linear Response ◽  
Canonical Basis ◽  
Time Dependent ◽  
Hartree Fock ◽  
Bogoliubov Theory

scholarly journals Multiresolution quantum chemistry in multiwavelet bases: excited states from time-dependent Hartree–Fock and density functional theory via linear response

2015 ◽  
Vol 17 (47) ◽  
pp. 31405-31416 ◽  
Author(s):  
Takeshi Yanai ◽  
George I. Fann ◽  
Gregory Beylkin ◽  
Robert J. Harrison
Keyword(s):  
Density Functional Theory ◽  
Quantum Chemistry ◽  
Numerical Method ◽  
Excited States ◽  
Multiresolution Analysis ◽  
Linear Response ◽  
Density Functional ◽  
Time Dependent ◽  
Functional Theory ◽  
Hartree Fock

A fully numerical method for the time-dependent Hartree–Fock and density functional theory (TD-HF/DFT) with the Tamm–Dancoff (TD) approximation is presented in a multiresolution analysis (MRA) approach.

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