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Hi
I am trying to run the EDA based on the Shubin Liu method to calculate the Esterics for my systems. After I load the .out file, Multiwfn closes with no results.
These are the files:
Input: https://drive.google.com/open?id=1b_Pvk … 0yQyz3906_
Output: https://drive.google.com/open?id=1yLbm5 … a6YR2ZO5Pz
Fch file: https://drive.google.com/open?id=1q-I08 … q4PxUSOKxU
I tried to change the functional and basis set but I still have the same problem.
Thanks for your help!
Pages: 1