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0 Replies
5477 Views |
December 09, 2011, 02:40:12 PMby QuantumDude |
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1 Replies
5489 Views |
October 04, 2017, 04:31:43 PM by romarine |
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LibXC index numbers
Started by martijn |
1 Replies
5505 Views |
October 25, 2019, 06:18:59 PM by uwe |
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SCF Iterations in TURBOMOLE 7.2
Started by saleheen_noman |
2 Replies
5550 Views |
May 04, 2018, 06:56:01 PM by saleheen_noman |
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functional equivalent for Xonly and Xalpha
Started by golden |
0 Replies
5586 Views |
February 14, 2013, 05:43:47 AM by golden |
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1 Replies
5683 Views |
October 14, 2011, 10:08:23 AM by andreas |
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1 Replies
5762 Views |
August 25, 2015, 10:49:31 AM by uwe |
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PEEC Manual Example
Started by foea |
0 Replies
5779 Views |
January 25, 2012, 10:22:32 AM by foea |
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DSCF $incore integer overflow
Started by f.uhlig |
0 Replies
5796 Views |
December 17, 2010, 06:02:22 PM by f.uhlig |
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1 Replies
5838 Views |
May 24, 2012, 01:35:42 PM by Arnim |
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2 Replies
5859 Views |
October 07, 2016, 01:51:31 PM by christof.haettig |
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dscf in parallel
Started by golden |
1 Replies
5938 Views |
September 06, 2012, 04:47:15 PM by golden |
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1 Replies
5971 Views |
May 05, 2014, 08:20:32 PM by mpjohans |
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reference in define of B97-D
Started by Stefan |
0 Replies
6006 Views |
April 04, 2011, 04:46:57 AM by Stefan |
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Error when using ghost atoms
Started by macrauha |
1 Replies
6011 Views |
September 15, 2015, 04:06:02 PM by Arnim |
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Executing Turbomole from chemshell
Started by yasser-qm |
2 Replies
6038 Views |
December 22, 2016, 09:32:47 AM by yasser-qm |
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2 Replies
6050 Views |
May 09, 2011, 01:31:37 PM by yasmeen |
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Printing out two electron integrals
Started by MarcMB |
1 Replies
6104 Views |
August 11, 2011, 06:13:17 PM by christof.haettig |
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can dos calculations run on parallel
Started by golden |
2 Replies
6149 Views |
February 29, 2012, 12:47:42 AM by golden |
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0 Replies
6181 Views |
March 19, 2010, 05:44:08 AM by ylniu |
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