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Re: Re: [abinit-forum] about convergence


Chronological Thread 
  • From: xd0533@163.com
  • To: forum@abinit.org
  • Subject: Re: Re: [abinit-forum] about convergence
  • Date: Mon, 14 May 2007 14:31:14 +0200

Dear Masayoshi,
Thank you for your answer.First, I use acell in Bohr.Second, I get xred from
ICSD.I am sure the structure(monoclinic) is correct. The distance between Gd
and Ta is correct,not close.I avoid tje mistakes you said referred.Thank you
all the same.



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