[Pw_forum] ibrav = 13 monoclinic-base-centered unique axis

Paolo Giannozzi p.giannozzi at gmail.com
Thu Jan 25 18:12:52 CET 2018


On Thu, Jan 25, 2018 at 5:34 PM, José Carlos Conesa <jcconesa at icp.csic.es>
wrote:

>
>       Input ibrav not compatible with space group number


You may need to specify "unique_b=.true."

-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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