Not able to apply ODAC25 on MOF74

#2
by AL-Adwan - opened

ERROR calculating MOF energy: No edges found in input system, this means either you have a single atom in the system or the atoms are farther apart than the radius cutoff of the model of 6 Angstroms. We don't know how to handle this case. Check the positions of system. I am always getting this error message no matter what structure I use.

Any idea?

AL-Adwan changed discussion title from Not able to apply ODAC25 on MOF74-- Structure not compatible! to Not able to apply ODAC25 on MOF74

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