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Theoretical studies of isomerization barriers of 2-pentoxy radical and its products
Ching Yeh Lin,
Jia Jen Ho
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Corresponding author for this work
Department of Chemistry
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INIS
barriers
100%
isomerization
100%
rings
75%
hydrogen transfer
50%
levels
25%
values
25%
energy
25%
carbon
25%
atoms
25%
oxygen
25%
density functional method
25%
reaction kinetics
25%
Chemistry
Chemical Reaction Product
100%
Structure
33%
Chemical Reaction
33%
Carbon
33%
Concentration
33%
Density Functional Theory
33%
Oxygen Atom
33%
Rate Constant
33%
DFT-B3LYP Calculation
33%
Energy Barrier
33%
Transition State
33%
Physics
Transferring
100%
Hydrogen
66%
Value
33%
Calculation
33%
Density Functional Theory
33%
Chemical Engineering
Isomerization
100%
Hydrogen Transfer
66%
Oxygen
33%
Carbon
33%
Earth and Planetary Sciences
Isomerization
100%