Development of a fully coupled diabatic spin–orbit model for the photodissociation of phenyl iodide N Weike, E Chanut, H Hoppe, W Eisfeld The Journal of Chemical Physics 156 (22), 2022 | 6 | 2022 |
A numerically exact correlation discrete variable representation for multi-configurational time-dependent Hartree calculations R Ellerbrock, H Hoppe, U Manthe The Journal of Chemical Physics 158 (24), 2023 | 5 | 2023 |
First-Principles Theory for the Reaction of Chlorine with Methane H Hoppe, U Manthe The Journal of Physical Chemistry Letters 13 (11), 2563-2566, 2022 | 5 | 2022 |
Eigenstate calculation in the state-averaged (multi-layer) multi-configurational time-dependent Hartree approach H Hoppe, U Manthe The Journal of Chemical Physics 160 (3), 2024 | 3 | 2024 |
A non-hierarchical multi-layer multi-configurational time-dependent Hartree approach for quantum dynamics on general potential energy surfaces R Ellerbrock, H Hoppe, U Manthe The Journal of Chemical Physics 160 (22), 2024 | 2 | 2024 |
QuTree: A tree tensor network package R Ellerbrock, KG Johnson, S Seritan, H Hoppe, JH Zhang, T Lenzen, ... The Journal of Chemical Physics 160 (11), 2024 | 2 | 2024 |
Accurate Quantum Dynamics Calculations for the Cl + CH4/CHD3/CD4 Reaction Rates H Hoppe, U Manthe The Journal of Physical Chemistry A, 2024 | | 2024 |
QuTree–A Tree Tensor Network Package S Seritan, H Hoppe, JH Zhang, T Lenzen, T Weike, U Manthe, TJ Martínez QUANTUM CHEMISTRY AND QUANTUM SIMULATION AT SCALE: LEVERAGING MODERN …, 2023 | | 2023 |