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1 Replies
2522 Views |
December 17, 2023, 11:18:13 PMby uwe |
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RDGRAD Failing in SMP with RIJK
Started by tjmustard |
1 Replies
6214 Views |
April 27, 2012, 12:27:37 PM by uwe |
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QMMM optimization using TURBOMOLE
Started by payelsahu |
0 Replies
7179 Views |
April 20, 2017, 08:58:09 AM by payelsahu |
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problems with jobex convcheck.f
Started by annaamat |
1 Replies
9104 Views |
March 25, 2008, 11:18:08 AM by uwe |
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1 Replies
7867 Views |
July 02, 2008, 05:36:20 PM by uwe |
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problem with "jobex -ex"
Started by kankanxiaoya |
1 Replies
6568 Views |
December 09, 2011, 09:00:35 AM by uwe |
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Problem finding local minium
Started by Turboooo |
2 Replies
5685 Views |
April 19, 2013, 09:07:20 AM by Turboooo |
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Pointing jobex to use ridft_smp
Started by jfurness |
2 Replies
4251 Views |
August 26, 2020, 06:41:06 PM by jfurness |
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Perrhenate, ECP, B3LYP
Started by wilhelm |
1 Replies
6043 Views |
April 26, 2011, 04:23:13 PM by Arnim |
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2 Replies
7231 Views |
June 06, 2021, 12:23:03 AM by JakubV |
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periodic boundary conditions
Started by asaf |
2 Replies
7184 Views |
August 29, 2011, 06:47:02 PM by pski |
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8 Replies
15734 Views |
May 09, 2008, 05:22:57 PM by uwe |
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1 Replies
5833 Views |
February 06, 2017, 09:44:50 AM by gunnar.schmitz |
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3 Replies
7429 Views |
October 26, 2011, 02:49:23 PM by Ian K |
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Optimized geometry
Started by 175116 |
6 Replies
17689 Views |
May 07, 2013, 08:47:07 PM by Turboooo |
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2 Replies
10299 Views |
April 24, 2007, 09:28:41 PM by lasermichel |
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5 Replies
9929 Views |
March 07, 2012, 02:22:23 PM by antti_karttunen |
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Optimization failed in excited state
Started by wuhen |
1 Replies
5945 Views |
July 22, 2011, 04:47:01 PM by amavr78 |
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Optimization error with symmetry
Started by ylniu |
0 Replies
6900 Views |
July 09, 2009, 09:09:12 AM by ylniu |
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8 Replies
6199 Views |
December 01, 2020, 06:41:36 PM by uwe |
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