Sunday, 29 October 2017

A Blog for learning VASP Calculations and Updates

Hi there..!

This would be a series of update on VASP code usage.

This may be useful for those who start VASP calculations from the SCRATCH.


You are encouraged to comment on the pages.
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Reason for the Maximum index for Augmentation-charges (SET IRDMAX)" error in OUTCAR file: VASP Calculation.

 "The Maximum index for Augmentation-charges (SET IRDMAX)" error is most-likely due to parallelization issues.  To check this, try...