Subject  / Started by |
Replies / Views | Last post | ||
|---|---|---|---|---|
|
|
No convergence with COSMO-RS
Started by mwoch |
0 Replies
5631 Views |
December 04, 2013, 02:28:04 PMby mwoch |
|
|
|
5 Replies
14719 Views |
April 17, 2012, 02:42:39 PM by antti_karttunen |
|
|
|
|
0 Replies
5137 Views |
June 16, 2012, 11:41:35 AM by jitmukherjeechem |
|
|
|
0 Replies
5337 Views |
January 22, 2016, 04:29:05 PM by uwe |
|
|
|
|
molecular dynamics not getting started
Started by vsharma |
1 Replies
6456 Views |
April 29, 2013, 10:34:58 AM by Arnim |
|
|
|
minimum energey crossing point (mecp)
Started by adam.kubas |
0 Replies
7451 Views |
September 13, 2009, 11:37:19 AM by adam.kubas |
|
|
|
metastase
Started by Matteo Guglielmi |
2 Replies
10131 Views |
February 27, 2009, 02:51:35 AM by Matteo Guglielmi |
|
|
|
0 Replies
9191 Views |
February 25, 2007, 08:17:45 PM by Lohengrin |
|
|
|
|
2 Replies
6864 Views |
November 13, 2012, 02:45:05 PM by vvallet |
|
|
|
|
jobex with peecm error in rdgrad step
Started by flabia |
2 Replies
6261 Views |
December 12, 2011, 09:25:09 AM by flabia |
|
|
|
jobex results in molecule rotation
Started by luyj |
5 Replies
8930 Views |
September 07, 2016, 04:43:02 PM by uwe |
|
|
|
3 Replies
9792 Views |
May 16, 2012, 12:38:48 PM by antti_karttunen |
|
|
|
|
0 Replies
6573 Views |
June 30, 2009, 07:29:34 AM by Guangyue |
|
|
|
|
2 Replies
7607 Views |
October 27, 2009, 04:05:44 PM by evgeniy |
|
|
|
|
0 Replies
7878 Views |
April 16, 2008, 02:19:34 PM by evgeniy |
|
|
|
|
IRC calculation
Started by marcel |
0 Replies
7655 Views |
September 09, 2008, 10:28:17 PM by marcel |
|
|
|
IRC (internal reaction coordinate)
Started by jbaltrus |
3 Replies
6683 Views |
March 17, 2012, 07:22:43 PM by Arnim |
|
|
|
2 Replies
4748 Views |
March 10, 2021, 11:46:49 AM by Krzmbrzl |
|
|
|
|
Implicit solvation in GFN2-xTB
Started by dw1032 |
0 Replies
5033 Views |
August 31, 2020, 10:49:11 AM by dw1032 |
|
|
|
I get no gradient file
Started by Lara |
6 Replies
9642 Views |
October 11, 2011, 02:52:37 PM by Lara |
Normal Topic
Hot Topic (More than 15 replies)
Very Hot Topic (More than 25 replies)
Locked Topic
Sticky Topic