The ABINIT Users Mailing List ( CLOSED )

[sederenzo@lbl.gov]

I would like to use ABINIT with information from the Inorganic Crystal 
Structure Database (a, b, c, alpha, beta, gamma, space group, irriducable 
atom coordinates). I understand from the ABINIT input variable description 
that the "SYMMETRIZER" can convert this information into the primative 
translational unit cell that ABINIT needs, but I have been unable to find any 
instructions or examples in FAQ, the tutorials, the search function, or the 
user ML.

I gather that input variables natrd, spgroup, natom, brvltt and xred are 
important but have not been able to find a successful combination by trial 
and error.

Thanks

Stephen Derenzo