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2 Replies
6851 Views |
September 22, 2016, 12:51:08 PMby marand |
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0 Replies
5646 Views |
December 06, 2012, 12:15:37 PM by vormar |
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Test ridft
Started by wojek |
3 Replies
8147 Views |
August 21, 2009, 09:48:01 AM by uwe |
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TM 6.3: problems with ridft (parallel)
Started by t.kerber |
4 Replies
6851 Views |
February 03, 2014, 03:13:38 PM by uwe |
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total density
Started by muyajt |
0 Replies
6819 Views |
April 14, 2010, 05:04:34 PM by muyajt |
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1 Replies
3331 Views |
July 10, 2023, 07:22:01 PM by uwe |
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Triplet scf converges to singlet
Started by akn123 |
1 Replies
2948 Views |
March 26, 2020, 08:28:19 AM by antti_karttunen |
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1 Replies
5545 Views |
October 04, 2017, 04:31:43 PM by romarine |
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two component DFT calcaulation
Started by lihb734 |
1 Replies
7187 Views |
August 02, 2009, 01:09:26 PM by mpjohans |
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Two-component calculations
Started by tayed |
0 Replies
5278 Views |
November 28, 2011, 10:46:00 AM by tayed |
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2 Replies
6905 Views |
April 13, 2011, 08:04:14 AM by antti_karttunen |
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two-electron integrals
Started by Dawood234 |
0 Replies
58 Views |
May 10, 2024, 06:29:50 PM by Dawood234 |
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Unrestricted DFT in H2 Dissociation
Started by Wook |
4 Replies
7924 Views |
March 27, 2017, 02:52:24 AM by Wook |
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2 Replies
6358 Views |
April 05, 2016, 06:09:34 PM by evgeniy |
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Use of fully separable ECP
Started by MarcMB |
0 Replies
5533 Views |
May 18, 2011, 09:02:16 AM by MarcMB |
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1 Replies
5815 Views |
August 25, 2015, 10:49:31 AM by uwe |
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4 Replies
9960 Views |
February 18, 2013, 04:15:10 PM by uwe |
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Wrong symmetry with desy (and energies)
Started by asaf |
14 Replies
13798 Views |
October 25, 2010, 05:48:34 PM by asaf |
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