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Welcome to my blog! As a computational chemist, I'm excited to share my knowledge and passion with you through my blogs on computational and AI chemistry. Let's learn and explore together!
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Computational Modeling Tutorials
Presentations
Cloud Computing
Machine learning
May 31, 2023
5 min read
Computational Modeling Tutorials
Transition State search using CI-NEB by VASP-VTST
The transition state (TS) of a chemical reaction is a particular configuration along the reaction coordinate. It is defined as the state...
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