An algorithm for estimating kinetic parameters of atomistic rare events using finite-time temperature programmed molecular dynamics trajectories-Reference-Cited by-同舟云学术

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An algorithm for estimating kinetic parameters of atomistic rare events using finite-time temperature programmed molecular dynamics trajectories

Published:2021-05 Issue: Volume:262 Page:107828
ISSN:0010-4655
Container-title:Computer Physics Communications
language:en
Short-container-title:Computer Physics Communications

Author:

Shivpuje Saurabh^ORCID,Kumawat Manish^ORCID,Chatterjee Abhijit

Funder

Science and Engineering Research Board

Publisher

Elsevier BV

Subject

General Physics and Astronomy,Hardware and Architecture

Reference35 articles.

1. Current Status of Transition-State Theory

2. Stochastic Processes in Physics and Chemistry;Van Kampen,1992

3. Handbook of Stochastic Methods;Gardiner,1985

4. Theory of Rate Processes;Glasstone,1941

5. Reaction Rate Theory and Rare Events;Peters,2017

Cited by 1 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. TPMD toolkit: A toolkit for studying rate processes using molecular dynamics trajectories and performing temperature programmed molecular dynamics calculations;Computer Physics Communications;2022-01

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