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Subsequent Escf runs - How to?
Started by marcen |
0 Replies
3283 Views |
March 14, 2018, 10:56:15 AMby marcen |
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Symmetry of excited states
Started by dcav |
0 Replies
3542 Views |
December 10, 2017, 12:45:02 PM by dcav |
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Temperature of Raman scatt. cross sections
Started by Punix |
0 Replies
3745 Views |
June 09, 2017, 09:34:59 AM by Punix |
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0 Replies
4160 Views |
September 21, 2016, 10:43:17 AM by Xiaoyan |
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1 Replies
7170 Views |
August 23, 2016, 03:03:00 AM by JakubV |
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Abnormal termination of egrad
Started by jakob |
1 Replies
5034 Views |
August 09, 2016, 08:51:54 PM by uwe |
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TDDFT excited state optimization fails
Started by basklau |
2 Replies
10376 Views |
July 26, 2016, 05:48:20 PM by JakubV |
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4 Replies
14891 Views |
April 21, 2016, 04:04:03 PM by JakubV |
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1 Replies
4680 Views |
November 20, 2015, 03:52:19 PM by christof.haettig |
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3 Replies
6459 Views |
October 21, 2015, 10:51:43 PM by christof.haettig |
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1 Replies
4842 Views |
October 01, 2015, 10:54:00 AM by christof.haettig |
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Strange excitations while using desy
Started by Kwiatkowski |
1 Replies
4531 Views |
October 01, 2015, 10:34:26 AM by christof.haettig |
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0 Replies
4726 Views |
February 06, 2015, 02:00:28 PM by Leprechaum |
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2 Replies
5595 Views |
February 05, 2015, 06:48:12 PM by Jerry |
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total dipole moment in egrad output
Started by tmartin |
1 Replies
5482 Views |
October 10, 2014, 11:25:12 AM by tmartin |
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1 Replies
6733 Views |
August 02, 2013, 03:48:13 PM by uwe |
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not enough core memory escf
Started by e.berardo |
3 Replies
6184 Views |
July 12, 2013, 04:44:21 PM by e.berardo |
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3 Replies
7170 Views |
May 18, 2013, 11:55:51 AM by antti_karttunen |
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6 Replies
9211 Views |
May 16, 2013, 02:56:33 PM by Hauke |
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Re and Im part for dynamic polarizability
Started by olga |
2 Replies
5918 Views |
April 15, 2013, 11:01:05 AM by olga |
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