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The Journal of Chemical Physics|March 29, 2013
Microscopic theory of singlet exciton fission. II. Application to pentacene dimers and the role of superexchangeTimothy C Berkelbach, Mark S Hybertsen, David R Reichman
The Journal of Chemical Physics|August 24, 2014
Microscopic theory of singlet exciton fission. III. Crystalline pentaceneTimothy C Berkelbach, Mark S Hybertsen, David R Reichman
The Journal of Physical Chemistry Letters|November 13, 2023
Can Spin-Component Scaled MP2 Achieve kJ/mol Accuracy for Cohesive Energies of Molecular Crystals?Yu Hsuan Liang, Hong-Zhou Ye, Timothy C Berkelbach
The Journal of Physical Chemistry Letters|August 8, 2022
Ground-State Properties of Metallic Solids from Ab Initio Coupled-Cluster TheoryVerena A Neufeld, Hong-Zhou Ye, Timothy C Berkelbach
The Journal of Chemical Physics|November 3, 2016
Employing an interaction picture to remove artificial correlations in multilayer multiconfiguration time-dependent Hartree simulationsHaobin Wang, Michael Thoss
The Journal of Chemical Physics|January 28, 2006
Quantum-mechanical evaluation of the Boltzmann operator in correlation functions for large molecular systems: a multilayer multiconfiguration time-dependent Hartree approachHaobin Wang, Michael Thoss
Annual Review of Physical Chemistry|May 1, 2004
Semiclassical description of molecular dynamics based on initial-value representation methodsMichael Thoss, Haobin Wang
The Journal of Chemical Physics|July 17, 2009
Numerically exact quantum dynamics for indistinguishable particles: the multilayer multiconfiguration time-dependent Hartree theory in second quantization representationHaobin Wang, Michael Thoss
The Journal of Physical Chemistry. A|March 20, 2013
Multilayer multiconfiguration time-dependent Hartree study of vibrationally coupled electron transport using the scattering-state representationHaobin Wang, Michael Thoss
The Journal of Chemical Physics|April 12, 2013
Numerically exact, time-dependent study of correlated electron transport in model molecular junctionsHaobin Wang, Michael Thoss
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