Keyphrases
Effective Implementation
100%
Hydrogen Shift
100%
Peroxy Radicals
100%
Shift Reaction
100%
Multiconformer Transition State Theory
100%
Electronic Structure Theory
66%
Reaction Rate
66%
Transition State
66%
Theory Structure
33%
Energy Transition
33%
Relative Energy
33%
Transition State Theory
33%
Cost-effective Approach
33%
Low Energy
33%
Computation Time
33%
Computational Cost
33%
Tunneling
33%
Large Systems
33%
R System
33%
Reaction Barrier
33%
Practical Implementation
33%
Engineering
Test System
66%
Energy Level
66%
Electronic State
66%
Conformers
66%
Experimental Result
33%
Tunnel Construction
33%
Energy Transition
33%
Effective Approach
33%
Computational Cost
33%
Computational Time
33%
Chemistry
Transition State Theory
100%
Hydrogen
100%
Transition State
66%
Electronic State
66%
Conformational Isomer
66%