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Questions related from Aulia Sukma Hutama
I am running calculations in vasp. I have checked the planewave cutoff convergence to 400 eV. However, I also use 550 eV to make sure that it is "safe". In geometry optimization, the one that has...
05 May 2015 2,241 1 View
I wonder, in several DFT packages, especially for the periodic boundary condition, we are always advised by the manual to use electronic temperature or smearing for bulk metal calculation. Why is...
11 November 2014 2,723 1 View
