Subject / Started by  |
Replies / Views | Last post | ||
|---|---|---|---|---|
|
|
Functionals
Started by 175116 |
1 Replies
7392 Views |
November 17, 2011, 03:57:42 PMby uwe |
|
|
|
RHF mos as UHF guess
Started by acapobia |
3 Replies
6981 Views |
December 09, 2013, 01:34:02 PM by Arnim |
|
|
|
Triplet scf converges to singlet
Started by akn123 |
1 Replies
2887 Views |
March 26, 2020, 08:28:19 AM by antti_karttunen |
|
|
|
1 Replies
3051 Views |
July 10, 2023, 07:22:01 PM by uwe |
|
|
|
|
1 Replies
10733 Views |
November 04, 2009, 05:52:22 PM by uwe |
|
|
|
|
1 Replies
7312 Views |
April 17, 2013, 01:49:54 PM by antti_karttunen |
|
|
|
|
4 Replies
10669 Views |
September 23, 2007, 03:05:12 PM by antti_karttunen |
|
|
|
|
2 Replies
6691 Views |
April 13, 2011, 08:04:14 AM by antti_karttunen |
|
|
|
|
dscf: fatal error in redrep
Started by antti_karttunen |
1 Replies
9360 Views |
May 31, 2007, 11:04:35 AM by uwe |
|
|
|
1 Replies
7322 Views |
May 22, 2009, 10:30:59 AM by uwe |
|
|
|
|
Is def2-TZVP O.K
Started by asaf |
7 Replies
16189 Views |
April 06, 2011, 07:48:09 PM by antti_karttunen |
|
|
|
Wrong symmetry with desy (and energies)
Started by asaf |
14 Replies
13559 Views |
October 25, 2010, 05:48:34 PM by asaf |
|
|
|
gradient accuracy - general question
Started by asaf |
2 Replies
6749 Views |
January 20, 2011, 02:38:08 PM by christof.haettig |
|
|
|
3 Replies
7370 Views |
October 21, 2010, 12:01:41 PM by uwe |
|
|
|
|
0 Replies
5402 Views |
December 26, 2010, 11:55:06 AM by asaf |
|
|
|
|
4 Replies
7709 Views |
March 16, 2011, 03:12:21 PM by asaf |
|
|
|
|
1e Integrals
Started by barbatti |
1 Replies
6300 Views |
September 07, 2013, 06:50:27 PM by uwe |
|
|
|
Pointcharges problem
Started by basklau |
2 Replies
6204 Views |
March 05, 2012, 04:15:59 PM by basklau |
|
|
|
negative homo-lumo gap
Started by bnikoobakht |
0 Replies
6217 Views |
January 08, 2013, 03:07:19 PM by bnikoobakht |
|
|
|
scratch directory in ridft
Started by Bob79 |
6 Replies
9482 Views |
August 22, 2013, 02:17:06 PM by uwe |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic