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Problems with TURBOMOLE - sTDA program
Started by inozerox |
2 Replies
34661 Views |
May 10, 2017, 06:30:39 PMby inozerox |
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3 Replies
46064 Views |
May 01, 2023, 07:39:51 PM by uwe |
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Really deep SCF energies DFT (with dscf)
Started by marilu98 |
6 Replies
69954 Views |
November 29, 2023, 06:23:41 PM by uwe |
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1 Replies
35963 Views |
September 18, 2020, 11:48:53 AM by uwe |
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resp charges with turbomole
Started by cesca_lb |
2 Replies
65926 Views |
November 26, 2016, 11:20:41 AM by cesca_lb |
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2 Replies
40604 Views |
May 10, 2007, 11:01:08 PM by turbomaster |
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Run BSSE with PBE-def2-QZVPPD
Started by prasanta13 |
5 Replies
55806 Views |
March 08, 2022, 05:25:04 AM by prasanta13 |
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Running COSMO in TURBOMOLE...
Started by willows9803 |
2 Replies
39726 Views |
January 28, 2008, 02:40:00 PM by willows9803 |
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1 Replies
36558 Views |
February 13, 2023, 02:58:39 PM by uwe |
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SDD basis set
Started by genneth9 |
2 Replies
42443 Views |
March 20, 2013, 10:22:07 AM by Arnim |
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Some question about basis set
Started by manyu |
2 Replies
49113 Views |
April 23, 2007, 05:54:34 PM by uwe |
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spin contrained UHF calculations.
Started by topherson |
2 Replies
32321 Views |
September 03, 2015, 12:20:05 PM by topherson |
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2 Replies
45539 Views |
June 23, 2025, 05:01:52 PM by avsfan92 |
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8 Replies
51326 Views |
March 05, 2014, 11:02:47 AM by hannesb |
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TM2Molden Error
Started by idet2 |
0 Replies
49096 Views |
November 13, 2007, 09:29:19 PM by idet2 |
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tm2molden in v.5.9
Started by Tobias_S |
3 Replies
58994 Views |
May 30, 2007, 09:29:22 PM by uwe |
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tm2molden, norm of d-functions
Started by sebastian |
1 Replies
50124 Views |
May 18, 2009, 02:02:40 PM by CoJack |
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Turbomole to cif conversion ?
Started by scope |
0 Replies
50191 Views |
August 08, 2007, 06:54:32 PM by scope |
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UFF atom types
Started by hmsenn |
1 Replies
34568 Views |
August 07, 2007, 05:21:14 PM by uwe |
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0 Replies
47355 Views |
September 24, 2008, 11:01:30 AM by slackenerny |
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