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- From: bin chen <binchen0401@gmail.com>
- To: forum@abinit.org
- Subject: [abinit-forum] help
- Date: Thu, 31 Dec 2009 21:26:53 +0800
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Dear all,
If i want to calculate phonons spectrum in the a certainly pressure .How
can i
choose the key words about pressure.
strfact
Mnemonics: STRess FACTor
Characteristic:
Variable type: real parameter
Default is 100.0 (Bohr^2)
The stresses multiplied by strfact will be treated like forces in the
process of optimization (ionmov=2, non-zero optcell).
For example, the stopping criterion defined by tolmxf relates to these
scaled stresses.
Above , I tried the key word but not got the result
Best wishes!
- [abinit-forum] help, bin chen, 12/31/2009
- Re: [abinit-forum] help, Aldo Humberto Romero, 12/31/2009
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