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• 1.7

  This Milestone will implement the q-space TDSCHA, with a massive N^2 speedup compared to 1.5 and an N speedup compared to 1.6. Besides these, we will also implement the new Hessian calculator with the fourth order exploiting the TDSCHA.

  No due date

  •1/6 issues closed
  16% complete5 open1 closed

• 2.0

  A big improvement on the tdscha code implementing: - novel symmetrization - GPU acceleration - short-range correction

  No due date

  •1/3 issues closed
  33% complete2 open1 closed