Gaussian and Kinisot: Kinetic Isotope Effect

GAUSSIAN TUTORIAL: LAZY WAY TO COMPUTE KINETIC ISOTOPE EFFECT
1. OBTAIN STRUCTURES OF REACTANTS AND TS IN G09
2. DOWNLOAD KINISOT (github.com/bob...)
3. USE KINISOT TO COMPUTE K.I.E.
Link to Henry Rzepa's blog: www.ch.imperial...

[@paulbk2322]

Thanks a lot for the immensely informative video. Can you please make a video on the process of calculating spin orbit coupling constant using Gaussian package?

[@meenupaliwal1086]

First of all, thank you for such a informational video. Which specific version of python supported by this program? I tried both 3.8.0 and 2.7 in windows. A error message saying "Syntax error: invalid syntax appears all the time. Can you please help me, i wanted to calculate KIE values for my research purpose? Looking forward to hearing from you.

[@froilanmathewdirecto9572]

Please make more videos. You are so helpful!!!!!!

[@dhiaadnan79]

And finaly we see u...it a long time u r not found

[@yingzhang3211]

looking forward to your classical way to calculate the KIE :)

[@qiaojueliu7982]

new video! miss u sooooo much!

[@IaNiusha]

:) I was finishing my thesis, but now I'm back on track!

[@dhiaadnan79]

IaNiusha could u send ur thesis to me my dear ???if u can pls

[@murtadhariad9084]

@@IaNiusha Hello. Please can I get mail ?

[@chandrasekharnettem1537]

when i used this commands : python Kinisot.py reactant_output ts_output -iso "1" it is coming like this. what can I do? KINISOT.py v 1.0.1: 2022-01-08 11:33 Wrong number of arguments used. Correct format: Kinisot.py 2 x g09_output_files -iso 1 2 3 (-t ) (-s ) (-cutoff )

[@chandrasekharnettem1537]

thanks . finally it worked .

[@Umarthechemist]

Hello. Please can I get email so I can send you questions and suggestions directly. Thanks

[@IaNiusha]

[e-mail]