[Pw_forum] Help me with the Band Structure Calculation
lan haiping
lanhaiping at gmail.com
Mon Feb 23 08:29:27 CET 2009
Hi, the weights of kpoints can be set to any value as decribed in the Doc.
On Mon, Feb 23, 2009 at 3:21 PM, yccheng.nju <yccheng.nju at gmail.com> wrote:
> You should set all number to "1" in the fourth column in kpoints. You
> have 311 K points, why you just give 5 in the input file. The error message
> have told you what your problem is !
>
>
> 2009-02-23
> ------------------------------
> yccheng.nju
> ------------------------------
> *发件人:* 潘登
> *发送时间:* 2009-02-23 15:14:13
> *收件人:* PWSCF Forum
> *抄送:*
> *主题:* Re: [Pw_forum] Help me with the Band Structure Calculation
> Dear yccheng.nju and nazari,
> I have tried to change to what you had suggested. But the error
> happens still, and the message unchange:
> from card_kpoints : error # 1
> error or end of file while reading tpiba k points
> And for nazari, I did have 311 k points but I just gave five of them
> and ommitted the others.
>
> Thanks for two of you, but I do not know where the problem is. Please help me.
> Have a nice day
> Pan Deng
> Nanjing University
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>
--
Hai-Ping Lan
Department of Electronics ,
Peking University , Bejing, 100871
lanhaiping at gmail.com, hplan at pku.edu.cn
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