[Pw_forum] How to understand filplot output file?
Nguyen Ngoc Ha
nguyenhalvt at yahoo.com
Mon Dec 18 17:16:39 CET 2006
Dear PWscf Users!
I calculated Local Density of State at E_Fermi for CO,
(not for plot). I received a filplot ouput file, but I
can't understand what in this file (I'm sorry).
Here is input:
&INPUTPP
outdir=
'/home/hthp/Desktop/TMP/TMP2/' ,
filplot = LDOS_Ef ,
plot_num = 3,
/
&PLOT
nfile = 0 ,
/
Here is output:
36 36 72 36 36 72 2 2
14 10.486 1.000 2.1556 0.000 0.000 0.0000
278.547393 4.000 25.000 3
1 O 6.00
2 C 4.00
1 0.501441847 0.724188345 0.633062794 2
2 0.503410729 0.635483111 0.818920961 1
1.50E-26 3.67E-27 -1.46E-26 -1.83E-27 1.19E-26
5.43E-27 2.02E-27 -6.94E-27 -7.88E-27 1.05E-28
...
Please help me this problem.
Best Regards!
Nguyen, Ngoc Ha
Hanoi University of Education
Faculty of Chemistry
Department of Physical Chemistry
Tel: Office: 04/8330842
Home: 04/7681083
Mobile: 0912129517
__________________________________________________
Do You Yahoo!?
Tired of spam? Yahoo! Mail has the best spam protection around
http://mail.yahoo.com
More information about the Pw_forum
mailing list