Recent content by vino

  1. vino

    Graduate Mastering DFT: Calculating Band Structures for Heterostructures

    It is commonly believed that DFT is a theory to predict ground state properties of a system only (e.g. the total energy, atomic structure, etc.), and that excited state properties cannot be determined by DFT. This is a misconception. In principle, DFT can determine any property (ground state or...
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    Graduate How choose k-points for 5*5*4 slab for band gap calculations

    Four layer surface with 5 atoms in x-direction and 5 atoms in y-direction
  3. vino

    Graduate How choose k-points for 5*5*4 slab for band gap calculations

    Is there any method for how to choose k-points in band structure calculations for aluminium slab 5*5*4 can somebody help in this question? Thanks
  4. vino

    Need Help with Coursework? Check Out Our Guidelines and Resources!

    I am from India. Support me in my threads. Thank YOU
  5. vino

    How to choose k-points for band structure calculations?

    Is there any method for how to choose k-points in band structure calculations can somebody help in this question? Thanks