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2 Replies
15913 Views |
September 15, 2021, 04:42:41 PMby uwe |
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Reading a weird basis set
Started by Kiwinator |
2 Replies
12164 Views |
January 08, 2009, 03:54:10 PM by Kiwinator |
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Ired crashes define
Started by Michael_Patzschke |
2 Replies
14485 Views |
October 12, 2023, 06:57:32 AM by Michael_Patzschke |
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2 Replies
13673 Views |
August 30, 2016, 02:11:44 PM by footballplayer |
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How to comment in define input file
Started by xiang |
2 Replies
12263 Views |
March 31, 2019, 07:37:20 PM by uwe |
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2 Replies
10927 Views |
July 16, 2014, 11:12:11 AM by evgeniy |
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2 Replies
13653 Views |
January 17, 2008, 02:30:34 PM by Kiwinator |
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2 Replies
12760 Views |
April 15, 2008, 07:19:17 PM by FKoehler |
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cant find all internal coordinates
Started by janwahl |
2 Replies
11949 Views |
September 07, 2009, 12:36:25 PM by janwahl |
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1 Replies
9792 Views |
February 16, 2015, 02:29:57 PM by uwe |
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start mos without define
Started by tmartin |
1 Replies
9762 Views |
September 23, 2014, 02:08:00 PM by Arnim |
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How to use "scanprep" script?
Started by ztehrani |
1 Replies
12053 Views |
May 16, 2017, 04:21:20 PM by Arnim |
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Auxilary (cbas
Started by evgeniy |
1 Replies
9630 Views |
February 13, 2014, 12:06:04 PM by antti_karttunen |
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gridsize and scfconv
Started by mboehme |
1 Replies
11117 Views |
February 14, 2013, 02:04:32 PM by Hauke |
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how to do optimization with out symmetry
Started by golden |
1 Replies
10155 Views |
March 22, 2012, 08:05:50 AM by antti_karttunen |
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Starting mos for supermolecule
Started by Robin1991 |
1 Replies
3786 Views |
December 21, 2024, 10:32:12 PM by uwe |
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Modifying basis functions
Started by jmmckel |
1 Replies
10781 Views |
May 22, 2009, 01:06:23 PM by andreas |
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1 Replies
11469 Views |
December 07, 2011, 10:04:35 AM by flabia |
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setting ECPs: define vs TmoleX
Started by ekirillov |
1 Replies
11613 Views |
November 24, 2009, 10:48:02 AM by christof.haettig |
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1 Replies
10595 Views |
November 24, 2009, 12:24:17 PM by christof.haettig |
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