[Pw_forum] problem with average.x

[Jiaye, Li]

Dear users

I want to calculate the planar and macroscopic averages of (100) surface.
But I met a problem with average.x. When i type "average.x
<input.avg.in|tee output.avg.out", it reported errors:
from plot_io : error # 209
opening file IO-O.pp
I checked my IO.O.pp file, this is the head of this file:


270 125 125 270 125 125 60 2
14 47.57399000 0.45986400 0.45986400 0.00000000 0.00000000 0.00000000
17198.9000207822 30.0000000000 10.0000000000 1
1 In 13.00
2 O 6.00
1 0.090550000 0.116092667 0.115044177 1
2 0.090550000 0.346001674 0.344953184 1
3 0.090550000 0.116092667 0.344953184 1
4 0.090550000 0.346001674 0.115044177 1
5 0.090550000 0.214908243 0.000045986 1
6 0.090550000 0.247181499 0.230000980 1
7 0.090550000 0.017226505 0.230000980 1
8 0.090550000 0.444863236 0.000045986 1
9 0.189360000 0.001089878 0.115044177 1
10 0.189360000 0.231044871 0.344953184 1
11 0.205500000 0.116092667 0.246091621 1
12 0.205500000 0.346001674 0.443819345 1
13 0.205500000 0.116092667 0.016182614 1
14 0.205500000 0.346001674 0.213864352 1
15 0.221640000 0.231044871 0.115044177 1
...
My input file for average.x is:

1 ! the number of 3D-FFT files
IO-O.pp
1.D0
1440
1
3.835000000


I can't find out what's wrong with the PP file for average.x, could anybody
help me with it? Thanks in advance.

-- 
Sincerely

Jiaye Li



==============================================
Li, Jiaye

M.S. in designing and developing novel materials

Research experience:
*ALD precursor. ie. Metal complexes
*Surface modification. ie. Indium tin oxide, SiO2
*Gas storage and adsorption. ie. Ionic Liquids

Skills:
*ab-initial method, DFT simulation and Force Field simulation

Please contact me at:
1. jameslipd at gmail.com  or
2. jameslibd at gmail.com

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