Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes
出版年份 2014 全文链接
标题
Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 140, Issue 17, Pages 174105
出版商
AIP Publishing
发表日期
2014-05-06
DOI
10.1063/1.4873135
参考文献
相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。- Ring-Polymer Molecular Dynamics: Quantum Effects in Chemical Dynamics from Classical Trajectories in an Extended Phase Space
- (2013) Scott Habershon et al. Annual Review of Physical Chemistry
- A new method to account for the difference between classical and quantum baths in quantum dissipative dynamics
- (2013) Lili Zhu et al. NEW JOURNAL OF PHYSICS
- Explicit system-bath correlation calculated using the hierarchical equations of motion method
- (2012) Lili Zhu et al. JOURNAL OF CHEMICAL PHYSICS
- Quantum rate dynamics for proton transfer reaction in a model system: Effect of the rate promoting vibrational mode
- (2011) Qiang Shi et al. JOURNAL OF CHEMICAL PHYSICS
- Dynamics and dissipation in enzyme catalysis
- (2011) N. Boekelheide et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Nonadiabatic Effects on Proton Transfer Rate Constants in a Nanoconfined Solvent
- (2010) Being J. Ka et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Tunneling in enzymatic and nonenzymatic hydrogen transfer reactions
- (2010) Donald G. Truhlar JOURNAL OF PHYSICAL ORGANIC CHEMISTRY
- Theoretical aspects of tunneling proton transfer reactions in a polar environment
- (2010) Philip M. Kiefer et al. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY
- The role of quantum effects in proton transfer reactions in enzymes: quantum tunneling in a noisy environment?
- (2010) Jacques P Bothma et al. NEW JOURNAL OF PHYSICS
- Quantum rate dynamics for proton transfer reactions in condensed phase: The exact hierarchical equations of motion approach
- (2009) Liping Chen et al. JOURNAL OF CHEMICAL PHYSICS
- A self-consistent treatment of electron transfer in the limit of strong friction via the mixed quantum classical Liouville method
- (2009) Qiang Shi et al. JOURNAL OF CHEMICAL PHYSICS
- Electron transfer dynamics: Zusman equation versus exact theory
- (2009) Qiang Shi et al. JOURNAL OF CHEMICAL PHYSICS
- Efficient hierarchical Liouville space propagator to quantum dissipative dynamics
- (2009) Qiang Shi et al. JOURNAL OF CHEMICAL PHYSICS
- A Theory−Experiment Conundrum for Proton Transfer
- (2008) Kevin S. Peters ACCOUNTS OF CHEMICAL RESEARCH
- Quantum-classical Liouville dynamics of proton and deuteron transfer rates in a solvated hydrogen-bonded complex
- (2008) Gabriel Hanna et al. JOURNAL OF CHEMICAL PHYSICS
- Proton transfer in a polar solvent from ring polymer reaction rate theory
- (2008) Rosana Collepardo-Guevara et al. JOURNAL OF CHEMICAL PHYSICS
Publish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn MoreAdd your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload Now