[Pw_forum] symmetries

Wohlwend, Jennifer L CTR USAF AFMC AFRL/RXBT Jennifer.Wohlwend.ctr at wpafb.af.mil
Wed Sep 29 20:46:15 CEST 2010


Is ltaucry=.true. still a resolution to the No Symmetry ! issue? I've tried
putting it in various places in the input and now get: 

task #        12

     from  read_namelists  : error #        19

      reading namelist control 

Which I did not get previously so I'm thinking it is b/c of the ltaucry tag?
A bit of background: I'm running P21/c structure with coordinates given in
angstroms; input is attached. <<...>> 

Jennifer L. Wohlwend, Ph.D.

Thermal Sciences and Materials Branch

Materials and Manufacturing Directorate

Air Force Research Laboratory

Ctr: Universal Technology Corporation

-------------- next part --------------
A non-text attachment was scrubbed...
Name: LiAlH4.in
Type: application/octet-stream
Size: 2739 bytes
Desc: not available
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20100929/f5ef8814/attachment.obj>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: smime.p7s
Type: application/x-pkcs7-signature
Size: 5738 bytes
Desc: not available
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20100929/f5ef8814/attachment.bin>


More information about the users mailing list