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The Journal of Chemical Physics|February 17, 2019
Vibronically and spin-orbit coupled diabatic potentials for X(P) + CH4 → HX + CH3 reactions: General theory and application for X(P) = F(2P)Tim Lenzen, Uwe MantheThe Journal of Physical Chemistry. A|April 10, 2013
Iterative diagonalization in the multiconfigurational time-dependent Hartree approach: ro-vibrational eigenstatesRobert Wodraszka, Uwe MantheThe Journal of Chemical Physics|September 3, 2017
Neural network based coupled diabatic potential energy surfaces for reactive scatteringTim Lenzen, Uwe MantheThe Journal of Physical Chemistry. A|May 14, 2024
Accurate Quantum Dynamics Calculations for the Cl + CH4/CHD3/CD4 Reaction RatesHannes Hoppe, Uwe MantheThe Journal of Physical Chemistry Letters|August 12, 2015
Loss of Memory in H + CH4 → H2 + CH3 State-to-State Reactive ScatteringRalph Welsch, Uwe MantheThe Journal of Chemical Physics|December 20, 2012
Decoherence induced by conical intersections: complexity constrained quantum dynamics of photoexcited pyrazineTill Westermann, Uwe MantheThe Journal of Chemical Physics|May 3, 2013
Fast Shepard interpolation on graphics processing units: potential energy surfaces and dynamics for H + CH4 → H2 + CH3Ralph Welsch, Uwe MantheThe Journal of Chemical Physics|June 21, 2011
Intramolecular proton transfer in malonaldehyde: accurate multilayer multi-configurational time-dependent Hartree calculationsThorsten Hammer, Uwe MantheThe Journal of Chemical Physics|April 9, 2022
A non-hierarchical correlation discrete variable representationRoman Ellerbrock, Uwe MantheThe Journal of Chemical Physics|May 17, 2019
Counter-propagating wave packets in the quantum transition state approach to reactive scatteringBin Zhao, Uwe ManthePageof 9