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Tue May 11 17:31:48 CEST 2010
Please suggest me. Thanks in advance.
Best Regards
Sanjay D. Gupta
~Best Regards
...........................................................
Sanjay D. Gupta
Research Fellow
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
Gujarat, Mobile-9879666643
email:guptasanjay_56 at yahoo.co.in
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Dear, PWSCF users,<br><br>Greetings!!!<br><br>Here I am facing problem of =
high pressure in per nitride materials. When we do scf using two different =
platform such as ABINIT and PWSCF, we got different pressure like abinit gi=
ve nearly 20 GPa and pwscf gives 2720.7 GPa, while I am using same geometry=
and even same strcture. Two codes should not differ so much, so I am not c=
lear, where i am doing mistake.<br>
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