[Wien] convert

[Tomas Kana]

Dear MAHDI SALMANI HIRMAND, 
 I think that you can describe hexagonal lattice using  P lattice. 
In Wien2k, the P lattice does not mean orthogonal, it can have some 
 angle different from 90 degrees. As far as I know, changing the letter H
(hexagonal) to P  does not affect the calculation if you have correct lattice parameters
 and angles (90, 90 120).
  Tomas 

------------ Původní zpráva ------------
Od: MAHDI SALMANI HIRMAND <mahdisa_right at yahoo.com>
Předmět: [Wien] convert
Datum: 05.4.2011 06:05:52
----------------------------------------
Dear Wien2k Users,
I need to describe other symmetries with P
lattice type ( P
lattice type can support all primitive lattices except Hexagonal symmetry).

Is it necessary to convert position of atoms for this goal or not?

If your answer is "YES" how?

Sincerely
Mahdi