>On 09/29/2010 07:46 PM, Wohlwend, Jennifer L CTR USAF AFMC AFRL/RXBT wrote: >> 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?
>Dear Jennifer, > I believe ltaucry was present in an old version of the code. >To specify positions in fractional coordinates, use: >ATOMIC_POSITIONS crystal > >Davide Right, but mine's in angstrom so I'm using ATOMIC_POSITIONS angstrom but I'm not sure why I'm getting no symmetry, I guess that was my real question. Thanks, Jen Jennifer L. Wohlwend, Ph.D. Thermal Sciences and Materials Branch Materials and Manufacturing Directorate Air Force Research Laboratory Ctr: Universal Technology Corporation Email: jennifer.wohlwend.ctr at wpafb.af.mil -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100929/d033d6ff/attachment-0001.htm -------------- next part -------------- A non-text attachment was scrubbed... Name: smime.p7s Type: application/x-pkcs7-signature Size: 5738 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20100929/d033d6ff/attachment-0001.bin
