5
B 1.38564 0.0 0.5
N 1.50111 0.0 0.5
K_POINTS {automatic}
10 10 1 0 0 0
CELL_PARAMETERS {hexagonal}
0.866025404 0.5 0.0
0.866025404 -0.5 0.0
0.0 0.0 1.94071
Please help me do a successful calculation.
Regards,
Bongani Ngwenya
Cell: 0027 84 429 53
? ? ? ? ? ?Can you give me a direction for my question about
> > MnSe. I am really struck in it...
> >
> > On Fri, Jan 21, 2011 at 12:40 PM, Lorenzo Paulatto
> > wrote:
> >>
> >> In data 20 gennaio 2011 alle ore 19:37:16, jia chen
> >> ha scritto:
> >> > I also
