Dear colleagues,
I have found a problem when running neb calculation for adsorption of CH4 on
MoN surface splitting to CH3 on Mo and H on N. I have attached the input file
for the calculation. The error shown will running on Compute Canada Server, its
crash down with an error of following:
It seems to me that "CI_scheme" is misspelled (with an "l" instead of a
capital "i") (or a lowercase "i": names of variables are case-insensitive)
Paolo
On Tue, Aug 4, 2020 at 5:43 PM Rutika Savaliya <
rutika.saval...@mail.mcgill.ca> wrote:
> Dear colleagues,
>
> I have found a problem when run
