[Wien] Gmax and geo optimization

[Zhijian WU]

Hi, there,

I have two questions to ask you concerning the wien2k package. 


1. Is it possible to optimize the geometry (with the lattice parameters and atom positions simultaneously, not just E-V or fixed c/a ratios, etc.) with wien2k? 

2. I wish to know the unit or dimension of Gmax (usually taken as 14)? I thought it is the unit of displacement (bohr radius). Any comments?

Thank you for your any of your comments.  I am looking forward to your early reply.

Seasonal greetings for all of you guys!

Zhijian Wu