[Pw_forum] need help

[kola srinivas]

Respected Sir,

I am doing some adsorption studies with anatase(101) surface with ultrasoft
pseudopotentials. my surface model is 2x1x2 with 15 angstroms vaccum space.
I am able to run in parallel with water adsorbed on the TiO2 surface. the
moment when i replaced water molecule with 2-Cyano-3-phenyl-acrylic acid it
is not doing any calculations in parallel. According to the process pid it
is showing that in all nodes the job has distributed, but doing nothing. I
tried with several options with npool and number of processors. please help
me in this regard.


yours sincerely,

K.Srinivas
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