Skip to Content.
Sympa Menu

forum - Re: [abinit-forum] what is the temperautre of the system?

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

Re: [abinit-forum] what is the temperautre of the system?


Chronological Thread 
  • From: Аксёнов Дмитрий <dimonaks@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] what is the temperautre of the system?
  • Date: Tue, 24 Nov 2009 22:52:36 +0300
  • Domainkey-signature: a=rsa-sha1; c=nofws; d=gmail.com; s=gamma; h=mime-version:in-reply-to:references:date:message-id:subject:from:to :content-type:content-transfer-encoding; b=mwdpgbxjhLK2D7OJZVgQMa6XRUEs4aS9UFDMCORQZox7p/50f5PiiwJIStNgmrbZtf xv7O73KSZO0MWqLsJP1WZLZ4Va0w9uzj+uNi2Tcg2t0+Q7fd9wGraTYDQXEHgIzx+see pXGdZbqbkzXTpPOhaIMlvhI4x9X2oj9bsBIP0=

Abinit uses density functional theory which is based on strictly
proven theorems only for ground state (T=0 К). I advice you to read
more about DFT(see abinit site) Using some aproximation it is possible
to include finite temperature in your calculation, but the default is
T=0 K



Archive powered by MHonArc 2.6.16.

Top of Page