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General: Aoforce & Numforce
Started by milianb |
1 Replies
7126 Views |
July 20, 2009, 11:08:56 AMby Arnim |
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Getting rid of imaginary frequencies
Started by Pfister |
14 Replies
25722 Views |
February 22, 2011, 10:16:40 PM by doguapo |
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Got two imaginary vibrational modes
Started by yeilkim23 |
1 Replies
4724 Views |
March 21, 2017, 11:43:00 AM by christof.haettig |
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HESSIAN for guess
Started by jbaltrus |
0 Replies
5975 Views |
June 06, 2009, 04:15:39 AM by jbaltrus |
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8 Replies
13412 Views |
June 28, 2017, 01:06:19 AM by JakubV |
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1 Replies
4253 Views |
January 28, 2015, 08:09:13 AM by antti_karttunen |
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2 Replies
9136 Views |
November 07, 2007, 05:40:57 PM by quant_m |
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0 Replies
4140 Views |
December 20, 2012, 07:41:20 PM by holyriver6 |
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How to run aoforce in parallel?
Started by Tiuri |
3 Replies
10713 Views |
May 10, 2007, 11:13:31 PM by turbomaster |
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Hybrid RI-DFT and aoforce
Started by antti_karttunen |
3 Replies
10037 Views |
February 19, 2014, 10:46:19 PM by uwe |
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include hessian in reoptimization
Started by greisen |
0 Replies
5650 Views |
October 16, 2011, 07:45:03 PM by greisen |
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0 Replies
5313 Views |
July 10, 2012, 08:58:16 PM by jbaltrus |
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2 Replies
8148 Views |
November 23, 2008, 08:37:12 PM by uwe |
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Modify memory settings for Numforce
Started by Glxblt76 |
8 Replies
8593 Views |
November 09, 2015, 02:37:08 PM by uwe |
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NumForce -- view Frequencies in molden
Started by basklau |
3 Replies
9249 Views |
August 08, 2008, 07:29:32 AM by antti_karttunen |
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NumForce and symmetry
Started by onthefly |
6 Replies
12879 Views |
May 20, 2015, 06:05:06 PM by Hauke |
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4 Replies
7952 Views |
February 14, 2013, 01:56:51 AM by Hauke |
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1 Replies
5886 Views |
July 20, 2010, 06:02:28 PM by christof.haettig |
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6 Replies
3700 Views |
February 17, 2022, 12:54:07 PM by Dempsey |
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Numforce MP2 for high temperatures
Started by Stegi |
2 Replies
5650 Views |
May 23, 2013, 05:03:23 PM by Stegi |
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