26 citations · 41 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2020★ 15 cited
Calculation of Reaction Rate Constants in the Canonical and Microcanonical Ensemble
Andreas Löhle, Johannes Kästner
Canonical instanton theory is a widespread approach to describe the dynamics of chemical reactions in low temperature environments when tunneling effects become dominant. It is a s…
physics.chem-ph2020★ 26 cited
Rate constants from instanton theory via a microcanonical approach
Sean R. McConnell, Andreas Löhle, Johannes Kästner
Microcanonical instanton theory offers the promise of providing rate constants for chemical reactions including quantum tunneling of atoms over the whole temperature range. We disc…