[QE-users] vc relax &cell namelist error
박민규
minkyupark at ulsan.ac.kr
Sat Jan 16 09:15:49 CET 2021
Dear Dash,
Please reverse the order of IONS and CELL namelist.
IONS namelist should appear first.
Best,
============================================
Minkyu Park
Research Institute of Basic Sciences, University of Ulsan,
93, Daehak-ro, Nam-gu, Ulsan, 44610 Republic of Korea
minkyupark at ulsan.ac.kr<mailto:minkyupark at ulsan.ac.kr>
+82-52-259-1473
============================================
On 16 Jan 2021, at 11:39 AM, Satyasiban Dash ph19d005 <ph19d005 at smail.iitm.ac.in<mailto:ph19d005 at smail.iitm.ac.in>> wrote:
Dear members,
Is it possible to do a vc-relax setting ibrav=0 and not providing celldm?
I tried it and although i specified &cell namelist , each time it says it can not find &cell namelist but when I am running relax , I am facing no problem.
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