How to define user coordinates for PED% using VEDA program?

08 August 2019 1 3K Report

I am looking for ways to do vibrational analysis for the molecule I studied. But I found very little about how to self-define coordinates. And I don't know the meaning of 's' or 'k' in the first column of automatically generated .dd2 file.

Does anyone know the logical way to do it?

A'Lester Allen

This link should help :-)

https://www.researchgate.net/post/Help_to_analysis_the_results_using_Vibrational_Energy_Distribution_Analysis_VEDA

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