Dear Graeme,
Thanks for your prompt response. Well, I think it's memory problem only, because with lower grid I am also able to run the Bader analysis. If you don't mind can you please share the configuration of your laptop, you ran this analysis, specifically memory usage? This will help me to ask ...
Search found 2 matches
- Mon Mar 04, 2019 5:50 pm
- Forum: Bader
- Topic: Problem while running bader charge Calculation
- Replies: 9
- Views: 153077
- Thu Feb 28, 2019 6:56 am
- Forum: Bader
- Topic: Problem while running bader charge Calculation
- Replies: 9
- Views: 153077
Re: Problem while running bader charge Calculation
I am having the same problem as mentioned by sgy002,
At line 89 of file chgcar_mod.f90 (unit = 100, file = 'CHGCAR')
Fortran runtime error: Bad real number in item 58996800 of list input.
I tried the suggestion and I am already running on linux machine with node of 8GB memory but it is still ...
At line 89 of file chgcar_mod.f90 (unit = 100, file = 'CHGCAR')
Fortran runtime error: Bad real number in item 58996800 of list input.
I tried the suggestion and I am already running on linux machine with node of 8GB memory but it is still ...