| Subject / Started by | Replies  / Views |
Last post | ||
|---|---|---|---|---|
|
|
Lineraly dependent basis set problem ?
Started by grog |
1 Replies
8462 Views |
April 29, 2008, 04:11:55 PMby uwe |
|
|
|
1 Replies
6774 Views |
October 01, 2015, 11:13:13 AM by christof.haettig |
|
|
|
|
1 Replies
8607 Views |
January 16, 2013, 07:20:32 PM by amavr78 |
|
|
|
|
1 Replies
10891 Views |
November 04, 2009, 05:52:22 PM by uwe |
|
|
|
|
two component DFT calcaulation
Started by lihb734 |
1 Replies
7130 Views |
August 02, 2009, 01:09:26 PM by mpjohans |
|
|
|
dscf - problem with 6d basis set?
Started by kulhanek |
1 Replies
7233 Views |
August 21, 2009, 09:45:11 AM by uwe |
|
|
|
$firstorder in TM 5.10
Started by l.goerigk |
1 Replies
7724 Views |
July 11, 2019, 02:14:26 PM by cneiss |
|
|
|
1 Replies
7482 Views |
May 22, 2009, 10:30:59 AM by uwe |
|
|
|
|
single point DFT covengercy problem
Started by gjgj |
1 Replies
7487 Views |
April 14, 2009, 01:31:30 PM by Arnim |
|
|
|
1 Replies
6753 Views |
April 14, 2009, 01:41:03 PM by Arnim |
|
|
|
|
1 Replies
6266 Views |
November 10, 2015, 10:54:13 AM by uwe |
|
|
|
|
Help for Ex and Ec components seperately
Started by igor |
1 Replies
7922 Views |
September 22, 2008, 04:12:05 PM by uwe |
|
|
|
Metal convergence problem
Started by sdTurb |
1 Replies
7495 Views |
November 02, 2010, 11:41:19 AM by uwe |
|
|
|
Energy decomposition analysis (EDA)
Started by sareeya |
1 Replies
7540 Views |
July 31, 2021, 05:26:27 PM by prasanta13 |
|
|
|
1 Replies
7467 Views |
April 17, 2013, 01:49:54 PM by antti_karttunen |
|
|
|
|
fermi and triplet occupation
Started by moere |
1 Replies
7168 Views |
October 25, 2010, 01:10:46 PM by Arnim |
|
|
|
PEECM-RIDFT Ended Abnormally
Started by naustin1 |
1 Replies
6814 Views |
June 18, 2015, 12:12:56 PM by Arnim |
|
|
|
1 Replies
8350 Views |
May 06, 2008, 09:27:54 AM by cml |
|
|
|
|
RI-UHF error without error message
Started by JakubV |
1 Replies
4878 Views |
November 12, 2017, 09:57:12 PM by uwe |
|
|
|
!! WARNING: HOMO-LUMO Gap is negativ !!
Started by martijn |
1 Replies
8635 Views |
January 28, 2009, 05:19:54 PM by uwe |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic