Transmission coefficient and recrossing
Research context
postgraduate concept · conditional · As of 2026-10-10
In classical transition-state trajectory counting, recrossing the dividing surface reduces the fraction of nominal crossings that contributes to net reaction; this recrossing transmission coefficient is bounded by one.
Key knowledge
In classical transition-state trajectory counting, recrossing the dividing surface reduces the fraction of nominal crossings that contributes to net reaction; this recrossing transmission coefficient is bounded by one. Solvent friction changes barrier-crossing dynamics. A quantum/tunneling correction defined relative to a classical transition-state rate is a different convention and need not be bounded by one.
Values and equations
k = kappa * k_TST
- k
- observed/model rate coefficient in the defined regime
- kappa
- transmission coefficient 1
- k_TST
- transition-state-theory rate coefficient in the same convention
Conditions and scope
- Specify dividing surface, reactant equilibration and dynamical regime; a correction is not a universal solvent constant.
Sources · 1
References
Sources retain their recorded scope. A source link alone does not establish verification of every statement.
Evidence and review
Concepts in Biophysical Chemistry: Kramers theory: Diffusive flux, friction and high-barrier steady-flux rate (relevant textbook section)
2026-10-10 · Bounded author source inspection of transmission coefficient and recrossing, including the stated conditions; independent branch review is recorded separately.
Entry details
Permanent link to this entry ↗- Record identity
- res-chem-transmission
- Revision
- research.1
- Structured reference record
- Postgraduate & research reference