ABINIT Discussion Forums

Dears

I tried to create an input file for the study of convergence in ecut (Energy cutoff), acell and k point and calculating the band structure of GaAs, Zinc Blende, but it gave me 18 inconsistencies in the my input file

Could any one of you please help me to create a correct input file?

Thanks

Dear hameed1987,
Inconsistencies in the input could originate from many things, basically you made mistakes in your input file and with the inconsistency error message abinit also tells you what is the problem and where in the input.
For GaAs, you have several automatic tests that can give you examples of input, for example in /tests/paral/Input/t54.in, just grep GaAs in all *.in files in this folder and you'll find other examples.
Best wishes,
Eric

ebousquet wrote:Dear hameed1987,
Inconsistencies in the input could originate from many things, basically you made mistakes in your input file and with the inconsistency error message abinit also tells you what is the problem and where in the input.
For GaAs, you have several automatic tests that can give you examples of input, for example in /tests/paral/Input/t54.in, just grep GaAs in all *.in files in this folder and you'll find other examples.
Best wishes,
Eric

Dear Eric
Thank you for the response it is appreciated

Regards
Hameed