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problems with S1 optimization
Started by jc3 |
1 Replies
7040 Views |
October 23, 2008, 01:03:43 PMby Arnim |
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1 Replies
7042 Views |
July 24, 2012, 02:03:58 PM by pwzhou |
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Spin-Orbit coupling
Started by plato |
0 Replies
7091 Views |
April 30, 2009, 10:38:58 PM by plato |
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3 Replies
7105 Views |
May 08, 2012, 03:27:25 PM by e.berardo |
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3 Replies
7234 Views |
October 21, 2015, 10:51:43 PM by christof.haettig |
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TDDFT calculations using b3-lyp functional
Started by golden |
1 Replies
7275 Views |
September 15, 2012, 09:42:11 PM by Christof |
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TPSS supported by escf?
Started by marius |
2 Replies
7283 Views |
December 13, 2010, 04:13:30 PM by barbatti |
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1 Replies
7377 Views |
June 02, 2008, 06:11:01 PM by christof.haettig |
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1 Replies
7409 Views |
August 02, 2013, 03:48:13 PM by uwe |
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Parallel version?
Started by cb |
1 Replies
7490 Views |
September 21, 2007, 11:38:21 PM by turbomaster |
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2 Replies
7745 Views |
March 31, 2008, 11:51:31 AM by christof.haettig |
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1 Replies
7814 Views |
August 23, 2016, 03:03:00 AM by JakubV |
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3 Replies
8075 Views |
May 18, 2013, 11:55:51 AM by antti_karttunen |
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2 Replies
8090 Views |
December 09, 2011, 06:22:34 PM by biophys2012 |
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triplet excitations with dft and hf
Started by motago |
2 Replies
8097 Views |
February 27, 2009, 01:26:02 AM by motago |
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1 Replies
8107 Views |
June 16, 2008, 01:12:51 PM by christof.haettig |
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2 Replies
8335 Views |
December 16, 2009, 10:48:08 AM by Stephan |
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exited state polarizability
Started by lsikk |
2 Replies
8837 Views |
March 27, 2009, 02:57:09 PM by christof.haettig |
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egrad error: nfun > 10
Started by sv |
4 Replies
8918 Views |
December 21, 2007, 11:43:47 AM by uwe |
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1 Replies
8933 Views |
February 26, 2007, 08:53:26 AM by uwe |
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