Subject / Started by | Replies / Views | Last post | ||
---|---|---|---|---|
Continue with optimization
Started by fgn1986 |
0 Replies
5277 Views |
May 24, 2012, 02:49:22 PM by fgn1986 |
||
0 Replies
5691 Views |
December 06, 2012, 12:15:37 PM by vormar |
|||
MOVED: rgf not found: Geometry optimization
Started by uwe |
0 Replies
8615 Views |
June 21, 2007, 09:24:31 PM by uwe |
||
0 Replies
4295 Views |
October 01, 2021, 01:06:36 AM by skundu07 |
|||
MOVED: Problem with Mpgrad
Started by christof.haettig |
0 Replies
10343 Views |
February 13, 2007, 03:35:12 PM by christof.haettig |
||
0 Replies
7279 Views |
March 17, 2008, 01:21:51 PM by slackenerny |
|||
Use of fully separable ECP
Started by MarcMB |
0 Replies
5576 Views |
May 18, 2011, 09:02:16 AM by MarcMB |
||
reference in define of B97-D
Started by Stefan |
0 Replies
6277 Views |
April 04, 2011, 04:46:57 AM by Stefan |
||
1 Replies
10994 Views |
November 04, 2009, 05:52:22 PM by uwe |
|||
Metal convergence problem
Started by sdTurb |
1 Replies
7596 Views |
November 02, 2010, 11:41:19 AM by uwe |
||
Help for Ex and Ec components seperately
Started by igor |
1 Replies
8021 Views |
September 22, 2008, 04:12:05 PM by uwe |
||
dscf: fatal error in redrep
Started by antti_karttunen |
1 Replies
9706 Views |
May 31, 2007, 11:04:35 AM by uwe |
||
single point DFT covengercy problem
Started by gjgj |
1 Replies
7588 Views |
April 14, 2009, 01:31:30 PM by Arnim |
||
dscf in parallel
Started by golden |
1 Replies
6215 Views |
September 06, 2012, 04:47:15 PM by golden |
||
1 Replies
6858 Views |
April 14, 2009, 01:41:03 PM by Arnim |
|||
1 Replies
7581 Views |
May 22, 2009, 10:30:59 AM by uwe |
|||
1 Replies
8453 Views |
May 06, 2008, 09:27:54 AM by cml |
|||
Lineraly dependent basis set problem ?
Started by grog |
1 Replies
8564 Views |
April 29, 2008, 04:11:55 PM by uwe |
||
dscf - problem with 6d basis set?
Started by kulhanek |
1 Replies
7335 Views |
August 21, 2009, 09:45:11 AM by uwe |
||
two component DFT calcaulation
Started by lihb734 |
1 Replies
7232 Views |
August 02, 2009, 01:09:26 PM by mpjohans |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic