Subject / Started by  |
Replies / Views | Last post | ||
|---|---|---|---|---|
|
|
how to know the total time in MD
Started by holyriver6 |
1 Replies
5128 Views |
March 17, 2014, 01:31:47 PMby Arnim |
|
|
|
0 Replies
4653 Views |
February 12, 2020, 01:34:56 PM by imardio |
|
|
|
|
Doubts with Molecular Orbitals
Started by inozerox |
3 Replies
6748 Views |
April 02, 2016, 02:54:53 PM by inozerox |
|
|
|
2 Replies
7224 Views |
June 06, 2021, 12:23:03 AM by JakubV |
|
|
|
|
4 Replies
7636 Views |
December 29, 2014, 09:23:44 PM by uwe |
|
|
|
|
3 Replies
9582 Views |
October 06, 2016, 06:01:46 PM by christof.haettig |
|
|
|
|
2 Replies
3881 Views |
June 14, 2021, 04:40:04 PM by Arnim |
|
|
|
|
UFF with external electric field
Started by JakubV |
0 Replies
3420 Views |
July 31, 2021, 11:20:39 PM by JakubV |
|
|
|
Thermostat usage in Molecular dynamics
Started by JakubV |
1 Replies
2792 Views |
January 13, 2023, 11:10:39 AM by Arnim |
|
|
|
1 Replies
3114 Views |
January 13, 2023, 11:19:55 AM by Arnim |
|
|
|
|
faults in run with jobbsse
Started by Jandir |
5 Replies
8373 Views |
March 24, 2014, 02:46:01 PM by Jandir |
|
|
|
IRC (internal reaction coordinate)
Started by jbaltrus |
3 Replies
6574 Views |
March 17, 2012, 07:22:43 PM by Arnim |
|
|
|
1 Replies
6589 Views |
May 19, 2010, 07:40:40 PM by jbaltrus |
|
|
|
|
1 Replies
6016 Views |
July 26, 2010, 12:36:21 PM by Arnim |
|
|
|
|
1 Replies
6091 Views |
February 09, 2016, 09:36:09 AM by Arnim |
|
|
|
|
Running PES scan in parallel with scanprep
Started by Jerry |
1 Replies
6276 Views |
September 30, 2015, 03:13:31 PM by christof.haettig |
|
|
|
Pointing jobex to use ridft_smp
Started by jfurness |
2 Replies
4175 Views |
August 26, 2020, 06:41:06 PM by jfurness |
|
|
|
shortage of memory!
Started by jitmukherjeechem |
0 Replies
5055 Views |
June 14, 2012, 05:46:36 PM by jitmukherjeechem |
|
|
|
0 Replies
5038 Views |
June 16, 2012, 11:41:35 AM by jitmukherjeechem |
|
|
|
|
how to find global minimum?
Started by jitmukherjeechem |
0 Replies
6407 Views |
June 20, 2012, 02:43:31 PM by jitmukherjeechem |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic