I have a set of saddle points of molecule with corresponding energy values. I would like to find the transition state of the molecule. I understand that transition state is the first-order saddle point. But I have a problem on realizing the definition to the real problem.
My question is: How do I select the particular saddle point to be a transition state? Is the structure corresponding highest energy a transition state?
I appreciate your answer.
Thank you.
ps: molecule has rotational transition state
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