"fixing" hand-made struct files [Re: [Wien] Modify the supercell-structure file!]

[Steven Homolya]

On Tue, 21 Oct 2003, Steven Homolya wrote:

> ...
> You just run it in your case directory to have your struct file "fixed" 
> (with hand-made struct file copied to case.struct).
> 
> Then proceed with init_lapw as per usual.
> 

Small correction. That should have read

 ... proceed with instgen and init_lapw ...

-- 
Steven Homolya
School of Physics and Materials Engineering
Monash University, VIC 3800
Australia
Tel: +61 3 9905 3694
Fax: +61 3 9905 3637