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how to do optimization with out symmetry
Started by golden |
1 Replies
5615 Views |
March 22, 2012, 08:05:50 AMby antti_karttunen |
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define on Windows
Started by Glxblt76 |
1 Replies
4867 Views |
June 06, 2020, 03:00:41 PM by uwe |
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Bug in damp within DEFINE script?
Started by Glxblt76 |
2 Replies
6850 Views |
April 02, 2019, 07:06:17 AM by Glxblt76 |
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heavy atoms without ecp
Started by fru14909 |
4 Replies
7339 Views |
March 02, 2021, 12:31:33 PM by Scoops |
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0 Replies
6791 Views |
March 10, 2017, 05:09:40 PM by footballplayer |
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2 Replies
9096 Views |
August 30, 2016, 02:11:44 PM by footballplayer |
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2 Replies
7671 Views |
April 15, 2008, 07:19:17 PM by FKoehler |
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2 Replies
3988 Views |
August 11, 2021, 11:01:09 AM by fedor |
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1 Replies
5324 Views |
December 04, 2011, 04:46:14 PM by evgeniy |
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No cc-pVDZ-PP auxiliary basis for Iridium
Started by evgeniy |
0 Replies
7059 Views |
June 01, 2017, 01:46:39 PM by evgeniy |
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On the def2-SV(P) basis sets
Started by evgeniy |
1 Replies
7840 Views |
April 07, 2008, 10:26:25 AM by Arnim |
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Very STRANGE error !!!
Started by evgeniy |
1 Replies
5408 Views |
July 21, 2010, 04:11:17 PM by christof.haettig |
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0 Replies
5511 Views |
March 26, 2010, 05:58:40 PM by evgeniy |
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2 Replies
8533 Views |
September 15, 2021, 04:42:41 PM by uwe |
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2 Replies
5957 Views |
July 16, 2014, 11:12:11 AM by evgeniy |
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Auxilary (cbas
Started by evgeniy |
1 Replies
5041 Views |
February 13, 2014, 12:06:04 PM by antti_karttunen |
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2 Replies
7404 Views |
June 03, 2008, 10:26:34 AM by evgeniy |
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5 Replies
8472 Views |
September 10, 2018, 09:45:45 PM by uwe |
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4 Replies
7757 Views |
August 23, 2018, 12:28:46 PM by evgeniy |
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0 Replies
5441 Views |
August 20, 2018, 02:03:21 PM by evgeniy |
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