Answer by Jack for k-points value in KPOINTS file for the VASP band calculation
Supplement some information to @ProfM's answer. Just for the logic.The first step with uniform k-mesh, such as 4x4x4 0 G 4 4 4 0 0 0is to perform a self-consistent calculation to obtain converged...
View ArticleAnswer by ProfM for k-points value in KPOINTS file for the VASP band calculation
The "10" indicates the number of $\mathbf{k}$-points that will be calculated along each path segment. For example, the first path segment from $(0.5,0.5,0.5)$ to $(0,0,0)$ will contain 10 points, and...
View Articlek-points value in KPOINTS file for the VASP band calculation
I'm a new VASP user, especially for the band structure calculations. I see that KPOINTS files are different for the GO/SP calculations and band calculations.For example in here it shows KPOINTS file...
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