Exponential parameterization of wave functions for quantum dynamics: Time-dependent Hartree in second quantization

Ab Initio Nonadiabatic Quantum Molecular Dynamics

(2018) Basile F. E. Curchod et al.   CHEMICAL REVIEWS

Tensor-decomposed vibrational coupled-cluster theory: Enabling large-scale, highly accurate vibrational-structure calculations

(2018) Niels Kristian Madsen et al.   JOURNAL OF CHEMICAL PHYSICS

A two-layer approach to the coupled coherent states method

(2016) James A. Green et al.   JOURNAL OF CHEMICAL PHYSICS

Quantum dynamics simulations using Gaussian wavepackets: the vMCG method

(2015) G.W. Richings et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

Calculating vibrational spectra without determining excited eigenstates: Solving the complex linear equations of damped response theory for vibrational configuration interaction and vibrational coupled cluster states

(2015) Ian H. Godtliebsen et al.   JOURNAL OF CHEMICAL PHYSICS

Multilayer Multiconfiguration Time-Dependent Hartree Theory

(2015) Haobin Wang   JOURNAL OF PHYSICAL CHEMISTRY A

Vibrational absorption spectra from vibrational coupled cluster damped linear response functions calculated using an asymmetric Lanczos algorithm

(2012) Bo Thomsen et al.   JOURNAL OF CHEMICAL PHYSICS

Compact MCTDH Wave Functions for High-Dimensional System-Bath Quantum Dynamics

(2012) M. Bonfanti et al.   JOURNAL OF PHYSICAL CHEMISTRY A

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

(2011) Oriol Vendrell et al.   JOURNAL OF CHEMICAL PHYSICS

Accurate multimode vibrational calculations using a B-spline basis: theory, tests and application to dioxirane and diazirinone

(2011) Daniele Toffoli et al.   MOLECULAR PHYSICS

Automatic derivation and evaluation of vibrational coupled cluster theory equations

(2009) Peter Seidler et al.   JOURNAL OF CHEMICAL PHYSICS

New Formulation and Implementation of Vibrational Self-Consistent Field Theory

(2009) Mikkel B. Hansen et al.   Journal of Chemical Theory and Computation

A multilayer multiconfigurational time-dependent Hartree approach for quantum dynamics on general potential energy surfaces

(2008) Uwe Manthe   JOURNAL OF CHEMICAL PHYSICS