Control pressure

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new_986
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Joined: Wed Aug 04, 2010 9:27 pm

Control pressure

Post by new_986 » Wed Feb 09, 2011 8:15 pm

Hi everyone...
could anyone tell me if there is possible to control on pressur in abinit>(i.e. if there is an input variable control pressure) ???
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jzwanzig
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Joined: Mon Aug 17, 2009 9:25 am

Re: Control pressure

Post by jzwanzig » Wed Feb 09, 2011 9:13 pm

See the input variable "strtarget", it defines the target stress tensor for an optimization.
Josef W. Zwanziger
Professor, Department of Chemistry
Canada Research Chair in NMR Studies of Materials
Dalhousie University
Halifax, NS B3H 4J3 Canada
jzwanzig@gmail.com
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