21.03.2017 11:58, Lyudmila Dobysheva wrote:
20.03.2017 22:11, Dr. K. C. Bhamu wrote:
1. I want to updated Gmax and R-MT*K-MAX after initialisation.
whether I need to redo the initialisation with
updated parameters or I can proceed without initialisation with updated
parameters?
These parameters do not require re-initialization.

Answering your another letter I understand that I should point here: though without re-initialization, but the -NI option should not be used here!

Best wishes
  Lyudmila Dobysheva
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