[QE-users] Increasing NSX Problems?

Ben Comer bcomer3 at gatech.edu
Thu Oct 24 21:25:21 CEST 2019


Hello,

I'm looking at running some systems with very complex spin 
configurations, and so would like to increase the allowable number of 
atom types to set more initial magnetic moments. I see from the archives 
that this can be done by modifying the Modules/parameters.f90 file. My 
only question is: will this have any adverse effects on the rest of the 
code (i.e. slowdown, seg faults, ect...)

Thanks,

Ben Comer



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