[Wien] A Valid .machines file

2010-04-29 Thread Xueli Wang
...@zeus.theochem.tuwien.ac.at] On Behalf Of Xueli Wang Sent: Tuesday, April 27, 2010 2:04 PM To: wien at zeus.theochem.tuwien.ac.at Subject: Re: [Wien] A Valid .machines file The same problem happened to me. But when I try to reform the .machines file into the following ones, it can be worked: 1:nx80 1:nx80 1:nx80 1:nx80

[Wien] A Valid .machines file

2010-04-29 Thread Xueli Wang
Dear Xueli, Thanks for the mail It works well but there is a message in the STDOUT /dev/stderr: no such device or address What does this mean SG From: wien-bounces at zeus.theochem.tuwien.ac.at [mailto:wien-boun...@zeus.theochem.tuwien.ac.at] On Behalf Of Xueli Wang Sent: Thursday, April

[Wien] A Valid .machines file

2010-04-27 Thread Xueli Wang
The same problem happened to me. But when I try to reform the .machines file into the following ones, it can be worked: 1:nx80 1:nx80 1:nx80 1:nx80 1:nx80 1:nx80 1:nx80 1:nx80 Granularity:1 Extrafine:1 Best wishes, Xueli Wang From: ssgh...@igcar.gov.in To: wien

[Wien] A Valid .machines file

2010-04-27 Thread Xueli Wang
And you can try to modify the number after Granularity, if you want to use the form of 1:nx80:8, the problem can also be resolved. 1:nx80:8 Granularity:8 Extrafine:1 Best regards, Xueli Wang From: wxlh...@msn.com To: wien at zeus.theochem.tuwien.ac.at Date: Tue, 27 Apr 2010 16:34

[Wien] Local Rotation Problems

2009-10-29 Thread Xueli Wang
to get the right QTL value by the right fermi energy?Thanks for your attention.Best regards,Xueli Wang From: wxlh...@msn.com To: wien at zeus.theochem.tuwien.ac.at Date: Thu, 22 Oct 2009 22:47:22 +0800 Subject: Re: [Wien] Local Rotation Problems Dear Prof. Blaha, Thanks for your reply. I

[Wien] Local Rotation Problems

2009-10-22 Thread Xueli Wang
0.1225 Thank you in advance, Xueli Wang -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20091022/59d68c94/attachment.htm

[Wien] DOS plot for FSM

2008-05-04 Thread Xueli Wang
. Thanks very much !Xueli Wang Phys. Dept. ,Huazhong University of Science and TechnologyWuhan, 430074 P.R.China Email: wxlhust at msn.com Phone: +86-27-87557517Mobile: +86-27-63567852 -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at