| Subject / Started by | Replies / Views | Last post  |
||
|---|---|---|---|---|
|
|
2 Replies
11 Views |
July 26, 2021, 04:18:15 PMby prasanta13 |
|
|
|
|
0 Replies
42 Views |
July 05, 2021, 02:42:46 PM by flzheng525 |
|
|
|
|
3 Replies
192 Views |
May 26, 2021, 05:03:58 PM by uwe |
|
|
|
|
intrinsic-atomic dipole moment
Started by Mohammad |
0 Replies
535 Views |
December 05, 2020, 09:04:32 PM by Mohammad |
|
|
|
3 Replies
669 Views |
October 22, 2020, 05:47:13 PM by jfurness |
|
|
|
|
Different results between t2x and t2x -c
Started by rkloditz |
2 Replies
561 Views |
October 09, 2020, 11:05:06 AM by rkloditz |
|
|
|
[HowTo] Generate NTOs from TDDFT
Started by finrod |
0 Replies
1404 Views |
March 17, 2020, 11:08:54 AM by finrod |
|
|
|
How to generat file47 for gennbo (NBO7)
Started by KrisR |
4 Replies
4622 Views |
July 18, 2019, 02:56:45 PM by KrisR |
|
|
|
Cube file export: erroneous shift?
Started by sheidrich |
2 Replies
3655 Views |
May 23, 2019, 05:21:46 PM by sheidrich |
|
|
|
hyperpolarizability
Started by jtravers |
1 Replies
2044 Views |
April 23, 2019, 11:27:48 AM by Arnim |
|
|
|
Set multiplicity on Turbomole
Started by Glxblt76 |
1 Replies
1941 Views |
April 23, 2019, 11:25:58 AM by Arnim |
|
|
|
Electrostatic potential
Started by djelenfi |
2 Replies
2377 Views |
March 28, 2019, 04:56:42 PM by djelenfi |
|
|
|
EDD visualization
Started by valienpo |
4 Replies
2768 Views |
February 28, 2019, 02:36:47 PM by valienpo |
|
|
|
Hirshfeld charges
Started by Andreas Heyden |
1 Replies
2006 Views |
February 27, 2019, 08:21:44 PM by uwe |
|
|
|
1 Replies
4997 Views |
November 17, 2016, 05:21:19 PM by christof.haettig |
|
|
|
|
1 Replies
4024 Views |
October 07, 2016, 02:22:23 PM by christof.haettig |
|
|
|
|
1 Replies
4291 Views |
October 07, 2016, 02:15:27 PM by christof.haettig |
|
|
|
|
Electrostatic potential map
Started by mariavd |
2 Replies
6185 Views |
May 11, 2016, 11:53:47 AM by mariavd |
|
|
|
3 Replies
11740 Views |
October 14, 2015, 10:47:38 AM by CharlesG |
|
|
|
|
WFN for two-component wave function
Started by mamaouch |
0 Replies
4238 Views |
August 24, 2015, 12:36:09 PM by mamaouch |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic