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0 Replies
8781 Views |
February 25, 2007, 08:17:45 PMby Lohengrin |
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metastase
Started by Matteo Guglielmi |
2 Replies
9770 Views |
February 27, 2009, 02:51:35 AM by Matteo Guglielmi |
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minimum energey crossing point (mecp)
Started by adam.kubas |
0 Replies
7135 Views |
September 13, 2009, 11:37:19 AM by adam.kubas |
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molecular dynamics not getting started
Started by vsharma |
1 Replies
6368 Views |
April 29, 2013, 10:34:58 AM by Arnim |
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0 Replies
5258 Views |
January 22, 2016, 04:29:05 PM by uwe |
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0 Replies
5052 Views |
June 16, 2012, 11:41:35 AM by jitmukherjeechem |
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5 Replies
14624 Views |
April 17, 2012, 02:42:39 PM by antti_karttunen |
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No convergence with COSMO-RS
Started by mwoch |
0 Replies
5540 Views |
December 04, 2013, 02:28:04 PM by mwoch |
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8 Replies
6420 Views |
December 01, 2020, 06:41:36 PM by uwe |
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Optimization error with symmetry
Started by ylniu |
0 Replies
6944 Views |
July 09, 2009, 09:09:12 AM by ylniu |
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Optimization failed in excited state
Started by wuhen |
1 Replies
5972 Views |
July 22, 2011, 04:47:01 PM by amavr78 |
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5 Replies
9952 Views |
March 07, 2012, 02:22:23 PM by antti_karttunen |
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2 Replies
10501 Views |
April 24, 2007, 09:28:41 PM by lasermichel |
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Optimized geometry
Started by 175116 |
6 Replies
17717 Views |
May 07, 2013, 08:47:07 PM by Turboooo |
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3 Replies
7450 Views |
October 26, 2011, 02:49:23 PM by Ian K |
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1 Replies
5852 Views |
February 06, 2017, 09:44:50 AM by gunnar.schmitz |
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8 Replies
15811 Views |
May 09, 2008, 05:22:57 PM by uwe |
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periodic boundary conditions
Started by asaf |
2 Replies
7210 Views |
August 29, 2011, 06:47:02 PM by pski |
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2 Replies
7262 Views |
June 06, 2021, 12:23:03 AM by JakubV |
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Perrhenate, ECP, B3LYP
Started by wilhelm |
1 Replies
6066 Views |
April 26, 2011, 04:23:13 PM by Arnim |
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