51 citations · 285 across the 11 of their papers we have counts for
4 papers · 1 filter
How an electrical current can stabilize a molecular nanojunction
André Erpenbeck, Yaling Ke, Uri Peskin +1
The stability of molecular junctions under transport is of the utmost importance for the field of molecular electronics. This question is often addressed within the paradigm of cur…
Current-induced forces in nanosystems: A hierarchical equations of motion approach
Samuel L. Rudge, Yaling Ke, Michael Thoss
A new approach to calculating current-induced forces in charge transport through nanosystems is introduced. Starting from the fully quantum mechanical hierarchical equations of mot…
Nonequilibrium reaction rate theory: Formulation and implementation within the hierarchical equations of motion approach
Yaling Ke, Christoph Kaspar, André Erpenbeck +2
The study of chemical reactions in environments under nonequilibrium conditions has been of interest recently in a variety of contexts, including current-induced reactions in molec…
Hierarchical equations of motion approach to hybrid fermionic and bosonic environments: Matrix product state formulation in twin space
Yaling Ke, Raffaele Borrelli, Michael Thoss
We extend the twin-space formulation of the hierarchical equations of motion approach in combination with the matrix product state representation (introduced in J. Chem. Phys. 150,…