<div>Hi</div>
<div> </div>
<div>I think my input file should be correct, since I made it according to the example. But when I submit a job, it always report:</div>
<div> Program POST-PROC v.4.0.3 starts ...<br> Today is 29Dec2008 at 17:36:39</div>
<div> Parallel version (MPI)</div>
<div> Number of processors in use: 2<br> R & G space division: proc/pool = 2</div>
<div> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br> from postproc : error # 225<br> reading inputpp namelist<br> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
</div>
<div>As a previous post pointed out that it may be due to the input file error, however, I think the input file should be a standard input file for surface calculation, could you help me with pick out where the error is from my input file? Thanks.</div>
<div> </div>
<div> &inputPP<br> outdir='/home/blade/jamesli/test/tmp', # temp files<br> plot_num=11 # the V_bare + V_H potential<br> filplot = 'IO-O.pp' # the quantity selected by plot_num<br>
/</div>
<div> &plot<br> iflag= 3, # 3D plot<br> output_format=3 # format suitable for XCRYSDEN (1D, 2D, 3D)<br>/<br><br clear="all"><br>-- <br>Sincerely<br>
<br>Jiaye Li<br><br><br><br>==============================================<br>Li, Jiaye<br><br>M.S. in designing and developing novel materials<br><br>Research experience: <br>*ALD precursor. ie. Metal complexes<br>*Surface modification. ie. Indium tin oxide, SiO2<br>
*Gas storage and adsorption. ie. Ionic Liquids<br><br>Skills:<br>*ab-initial method, DFT simulation and Force Field simulation<br><br>Please contact me at: <br>1. <a href="mailto:jameslipd@gmail.com">jameslipd@gmail.com</a> or<br>
2. <a href="mailto:jameslibd@gmail.com">jameslibd@gmail.com</a><br><br>==============================================<br></div>