BACK to that split interstitial

  • We deduced the nature of the hybridization from geometry.

  • Now we can look at it and in the next page we will show the same sample, relaxed in VASP and then show the electron density near the split interstitial from above.
  • 49th frame of interstitial formation

    These slides online at http://phycomp.technion.ac.il/~phr76ja/CCP2010