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error in definite matrix
Started by ztehrani |
0 Replies
29420 Views |
May 12, 2017, 01:00:56 PMby ztehrani |
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How to use "scanprep" script?
Started by ztehrani |
1 Replies
33439 Views |
May 16, 2017, 04:21:20 PM by Arnim |
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Up to a million dummy atoms
Started by Zessin |
3 Replies
53003 Views |
November 19, 2010, 11:08:48 AM by uwe |
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RI-approximation in Turbomole
Started by zahra |
4 Replies
45421 Views |
March 21, 2017, 11:23:53 AM by christof.haettig |
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B-p86 functional in Turbomole
Started by zahra |
2 Replies
69685 Views |
February 17, 2017, 12:15:23 PM by zahra |
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0 Replies
26212 Views |
October 30, 2015, 05:42:15 AM by yuniawan |
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Re: eht for ion Rb
Started by yuniawan |
8 Replies
56370 Views |
November 02, 2015, 02:24:45 PM by yuniawan |
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Automatimg Define
Started by ym21d@fsu.edu |
7 Replies
74089 Views |
June 25, 2025, 08:45:21 PM by ym21d@fsu.edu |
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Dhoosing a singelt open shell state
Started by ym21d@fsu.edu |
5 Replies
55473 Views |
August 14, 2025, 01:51:46 PM by uwe |
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setting for rimp2 caculation with ricc2
Started by YangSiYa |
3 Replies
40207 Views |
February 05, 2009, 02:22:12 PM by christof.haettig |
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How to comment in define input file
Started by xiang |
2 Replies
58192 Views |
March 31, 2019, 07:37:20 PM by uwe |
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how to assign def-ecp basis set
Started by wuhen |
2 Replies
55190 Views |
September 04, 2010, 02:20:53 PM by wuhen |
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0 Replies
47009 Views |
September 04, 2010, 02:28:33 PM by wuhen |
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2 Replies
44558 Views |
February 19, 2008, 02:39:29 PM by willows9803 |
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system charge
Started by wilhelm |
3 Replies
52411 Views |
November 18, 2010, 06:02:19 PM by christof.haettig |
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1 Replies
48367 Views |
February 15, 2010, 10:33:01 AM by Arnim |
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1 Replies
51015 Views |
February 16, 2015, 02:29:57 PM by uwe |
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3 Replies
43863 Views |
June 02, 2008, 06:17:38 PM by christof.haettig |
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1 Replies
29587 Views |
December 07, 2011, 10:04:35 AM by flabia |
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start mos without define
Started by tmartin |
1 Replies
48616 Views |
September 23, 2014, 02:08:00 PM by Arnim |
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