| Subject / Started by | Replies  / Views |
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BSSE calculations
Started by juanjo |
3 Replies
8277 Views |
September 20, 2012, 03:46:10 PMby uwe |
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visualizing natural orbitals
Started by patrikrydberg |
3 Replies
11724 Views |
October 16, 2017, 11:54:48 AM by mansaribhu |
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Frozen coordinates
Started by idet2 |
3 Replies
10145 Views |
November 19, 2007, 05:17:24 PM by idet2 |
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Maximum number of atoms
Started by mike |
2 Replies
7978 Views |
March 09, 2018, 11:07:42 AM by uwe |
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resp charges with turbomole
Started by cesca_lb |
2 Replies
6520 Views |
November 26, 2016, 11:20:41 AM by cesca_lb |
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cartesian coordinates
Started by Jandir |
2 Replies
4921 Views |
November 25, 2013, 03:10:35 AM by Jandir |
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Huge Binaries
Started by idet2 |
2 Replies
6220 Views |
June 30, 2009, 08:43:15 AM by idet2 |
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Keywords for density matrix, fock matrix
Started by Amin |
2 Replies
3019 Views |
June 22, 2023, 03:38:22 PM by Amin |
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diffuse basis set
Started by Turboooo |
2 Replies
5321 Views |
March 15, 2013, 05:47:50 PM by Turboooo |
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potential surface scan
Started by saikat403 |
2 Replies
6349 Views |
October 11, 2019, 09:39:34 PM by saikat403 |
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Some question about basis set
Started by manyu |
2 Replies
14581 Views |
April 23, 2007, 05:54:34 PM by uwe |
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2 Replies
7153 Views |
May 10, 2007, 11:01:08 PM by turbomaster |
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2 Replies
6705 Views |
August 11, 2011, 06:17:07 PM by christof.haettig |
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Running COSMO in TURBOMOLE...
Started by willows9803 |
2 Replies
9097 Views |
January 28, 2008, 02:40:00 PM by willows9803 |
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2 Replies
11394 Views |
April 24, 2008, 04:57:05 PM by bademoor |
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spin contrained UHF calculations.
Started by topherson |
2 Replies
7151 Views |
September 03, 2015, 12:20:05 PM by topherson |
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Problems with TURBOMOLE - sTDA program
Started by inozerox |
2 Replies
5720 Views |
May 10, 2017, 06:30:39 PM by inozerox |
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2 Replies
8010 Views |
February 13, 2019, 09:17:34 PM by Desang |
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SDD basis set
Started by genneth9 |
2 Replies
11765 Views |
March 20, 2013, 10:22:07 AM by Arnim |
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UFF atom types
Started by hmsenn |
1 Replies
6907 Views |
August 07, 2007, 05:21:14 PM by uwe |
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