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Figure
5
.
The whole 1D reaction profile calculated from TS1 as a function of
r
(x,y)
From
Exploring Potential Energy Surface with
Mathematica
: An Algorithmic Demonstration of Minimum Energy Path, Stationary Points and Transition State
Krishnamohan G. P., Omar H., Sreeja T. D., Roy K. B.
World Journal of Chemical Education
.
2022
, 10(4), 124-130 doi:10.12691/wjce-10-4-1
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