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The Journal of Chemical Physics|June 17, 2018
Full-dimensional quantum dynamics calculations for H + CHD<sub>3</sub> → H<sub>2</sub> + CD<sub>3</sub>: The effect of multiple vibrational excitationsRoman Ellerbrock, Uwe Manthe
The Journal of Chemical Physics|April 3, 2012
A multi-configurational time-dependent Hartree approach to the eigenstates of multi-well systemsRobert Wodraszka, Uwe Manthe
The Journal of Chemical Physics|June 7, 2012
First principle nonlinear quantum dynamics using a correlation-based von Neumann entropyTill Westermann, Uwe Manthe
The Journal of Chemical Physics|November 10, 2014
The role of the transition state in polyatomic reactions: initial state-selected reaction probabilities of the H + CH₄ → H₂ + CH₃ reactionRalph Welsch, Uwe Manthe
The Journal of Chemical Physics|August 3, 2012
A full-dimensional wave packet dynamics study of the photodetachment spectra of FCH4(-)Juliana Palma, Uwe Manthe
The Journal of Physical Chemistry. A|August 14, 2015
A Quasiclassical Study of the F((2)P) + CHD3 (ν1 = 0,1) Reactive System on an Accurate Potential Energy SurfaceJuliana Palma, Uwe Manthe
The Journal of Physical Chemistry Letters|March 14, 2022
First-Principles Theory for the Reaction of Chlorine with MethaneHannes Hoppe, Uwe Manthe
The Journal of Chemical Physics|May 27, 2010
Communications: A rigorous transition state based approach to state-specific reaction dynamics: Full-dimensional calculations for H+CH(4)-->H(2)+CH(3)Gerd Schiffel, Uwe Manthe
The Journal of Chemical Physics|August 27, 2005
Multidimensional time-dependent discrete variable representations in multiconfiguration Hartree calculationsRob van Harrevelt, Uwe Manthe
The Journal of Chemical Physics|July 16, 2008
Calculating vibrational spectra using modified Shepard interpolated potential energy surfacesChristian R Evenhuis, Uwe Manthe
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