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3 Replies
11156 Views |
May 18, 2013, 11:55:51 AMby antti_karttunen |
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problems with S1 optimization
Started by jc3 |
1 Replies
9901 Views |
October 23, 2008, 01:03:43 PM by Arnim |
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qsGW vs evGW convergence
Started by martijn |
2 Replies
8718 Views |
April 23, 2021, 10:45:55 AM by martijn |
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Re and Im part for dynamic polarizability
Started by olga |
2 Replies
9389 Views |
April 15, 2013, 11:01:05 AM by olga |
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rigw_contour vs rigw vs GW
Started by martijn |
5 Replies
9677 Views |
August 01, 2020, 11:40:08 AM by chris.hol |
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1 Replies
8447 Views |
March 08, 2012, 02:23:14 PM by antti_karttunen |
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5 Replies
17444 Views |
March 10, 2009, 12:30:48 AM by ylniu |
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singlet excitation
Started by lsikk |
4 Replies
14223 Views |
June 05, 2007, 11:37:44 AM by lsikk |
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4 Replies
20530 Views |
April 21, 2016, 04:04:03 PM by JakubV |
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SOC Constants
Started by hherbol |
0 Replies
2586 Views |
October 29, 2024, 03:32:58 PM by hherbol |
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Spin-Orbit coupling
Started by plato |
0 Replies
9920 Views |
April 30, 2009, 10:38:58 PM by plato |
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Strange excitations while using desy
Started by Kwiatkowski |
1 Replies
7945 Views |
October 01, 2015, 10:34:26 AM by christof.haettig |
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Subsequent Escf runs - How to?
Started by marcen |
0 Replies
6703 Views |
March 14, 2018, 10:56:15 AM by marcen |
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4 Replies
9539 Views |
September 23, 2021, 11:10:58 PM by martijn |
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Symmetry of excited states
Started by dcav |
0 Replies
6878 Views |
December 10, 2017, 12:45:02 PM by dcav |
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TD DFT - excited state natural orbitals
Started by qadir |
5 Replies
13461 Views |
March 19, 2020, 04:28:02 PM by finrod |
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3 Replies
10116 Views |
May 08, 2012, 03:27:25 PM by e.berardo |
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TDDFT calculations using b3-lyp functional
Started by golden |
1 Replies
10021 Views |
September 15, 2012, 09:42:11 PM by Christof |
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TDDFT cosmo
Started by jbaltrus |
0 Replies
7774 Views |
October 02, 2010, 01:56:30 AM by jbaltrus |
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TDDFT excited state optimization fails
Started by basklau |
2 Replies
14248 Views |
July 26, 2016, 05:48:20 PM by JakubV |
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