Time‐dependent coupled‐cluster theory

B Sverdrup Ofstad, E Aurbakken… - Wiley …, 2023 - Wiley Online Library
Recent years have witnessed an increasing interest in time‐dependent coupled‐cluster
(TDCC) theory for simulating laser‐driven electronic dynamics in atoms and molecules, and …

Colloquium: Multiconfigurational time-dependent Hartree approaches for indistinguishable particles

AUJ Lode, C Lévêque, LB Madsen, AI Streltsov… - Reviews of Modern …, 2020 - APS
In this Colloquium, the wave-function-based multiconfigurational time-dependent Hartree
approaches to the dynamics of indistinguishable particles (MCTDH-F for fermions and …

[BUCH][B] Multidimensional quantum dynamics: MCTDH theory and applications

HD Meyer, F Gatti, GA Worth - 2009 - books.google.com
The first book dedicated to this new and powerful computational method begins with a
comprehensive description of MCTDH and its theoretical background. There then follows a …

Multilayer multiconfiguration time-dependent Hartree method: Implementation and applications to a Henon–Heiles Hamiltonian and to pyrazine

O Vendrell, HD Meyer - The Journal of Chemical Physics, 2011 - pubs.aip.org
The multilayer multiconfiguration time-dependent Hartree (ML-MCTDH) method is discussed
and a fully general implementation for any number of layers based on the recursive ML …

[BUCH][B] From quantum to classical molecular dynamics: reduced models and numerical analysis

C Lubich - 2008 - books.google.com
Quantum dynamics of molecules poses a variety of computational challenges that are
presently at the forefront of research efforts in numerical analysis in a number of application …

Multiconfigurational time-dependent Hartree method for bosons: Many-body dynamics of bosonic systems

OE Alon, AI Streltsov, LS Cederbaum - Physical Review A—Atomic, Molecular …, 2008 - APS
The evolution of Bose-Einstein condensates is amply described by the time-dependent
Gross-Pitaevskii mean-field theory which assumes all bosons to reside in a single time …

Correlated multielectron systems in strong laser fields: A multiconfiguration time-dependent Hartree-Fock approach

J Caillat, J Zanghellini, M Kitzler, O Koch… - Physical Review A …, 2005 - APS
The multiconfiguration time-dependent Hartree-Fock approach for the description of
correlated few-electron dynamics in the presence of strong laser fields is introduced and a …

Studying molecular quantum dynamics with the multiconfiguration time‐dependent Hartree method

HD Meyer - Wiley Interdisciplinary Reviews: Computational …, 2012 - Wiley Online Library
This review covers the multiconfiguration time‐dependent Hartree (MCTDH) method, which
is a powerful and general algorithm for solving the time‐dependent Schrödinger equation …

Time-dependent multiconfiguration theory for electronic dynamics of molecules in an intense laser field

T Kato, H Kono - Chemical physics letters, 2004 - Elsevier
A multiconfiguration theory for electronic dynamics of molecules in an intense laser field is
developed based on the Dirac–Frenkel time-dependent variational principle. The equations …

Polaritonic response theory for exact and approximate wave functions

M Castagnola, RR Riso, A Barlini… - Wiley Interdisciplinary …, 2024 - Wiley Online Library
Polaritonic chemistry is an interdisciplinary emerging field that presents several challenges
and opportunities in chemistry, physics, and engineering. A systematic review of polaritonic …