The code in test dosen't work

eljost / nddia

N/D diabatiziation of adiabatic potential energy curves.

GNU Lesser General Public License v3.0

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The code in test dosen't work #1

Open yykphy opened 6 months ago

yykphy commented 6 months ago

It seems to be a very very useful code for those studying theoretical chemistry. Unfortunately, the codes in test cannot work. Looking forward to updates

eljost commented 6 months ago

I made some updates to the code. Please let me know, if this solves your problem(s).