Home Forums electronic structure electronic structure – chapter forum Question at end of the video

Viewing 3 posts - 1 through 3 (of 3 total)
  • Author
    Posts
  • #7381
    edeas546
    Participant

    I am not really understanding, how to view the increasing of lattice parameter a. Lets see it in 1D. Volume of the unit cell is a.
    Reciprocal vector is 2 \pi /a , so volume of FBZ will be 2\pi /a . If we increase the lattice parameter a, the volume of a unit cell in real space increases but in reciprocal space decreases.

    Lets take a finite crystal with Length L (fixed) = N*a. So if we increase a , the number of unit cells will decrease. Also the size of the FBZ got smaller. Therefore the number of reachable k points in FBZ becomes less. How is it possible to still few the band structure spectrum as a continious fct? I dont get from that point of view how the bands will flatten.

    For a free atom, the lattice parameter goes to infinite so the FBZ gets infinite small, therefore there will be no reachable k points anymore. From this point of view there is no possbile way to draw E(k) and the concept doesnt make sense to me.
    Any help ?
    Cheers

    #7722
    Ruben Quiroz
    Participant

    A part of the answer is that L doesn’t remain fixed. When we increase the lattice parameter and keep the amount of atoms fixed, they move further apart. This makes L increase!

    The rest of the question I don’t quite know the answer to.

    #7804

    The unanswered part of the question will be dealt with in the feedback webinar.

Viewing 3 posts - 1 through 3 (of 3 total)
  • You must be logged in to reply to this topic.
Scroll to Top