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MP2 energies of large systems
Started by cediev87 |
2 Replies
6669 Views |
May 22, 2012, 09:53:07 AMby uwe |
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1 Replies
6074 Views |
July 20, 2010, 05:21:31 PM by christof.haettig |
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1 Replies
6585 Views |
July 18, 2013, 04:57:12 PM by uwe |
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ADC(2) transition moment calculation
Started by david.mester |
1 Replies
5880 Views |
March 23, 2017, 02:58:20 PM by christof.haettig |
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2 Replies
5799 Views |
July 31, 2014, 02:18:01 PM by dbk80 |
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Negative excitation energies in ADC(2)
Started by dcav |
2 Replies
6002 Views |
November 18, 2019, 11:58:07 AM by christof.haettig |
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RICC2 excited state multiplicity
Started by djelenfi |
1 Replies
3697 Views |
November 18, 2019, 11:44:21 AM by christof.haettig |
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RICC2 not all excited state
Started by djelenfi |
1 Replies
2800 Views |
February 10, 2020, 08:47:19 AM by gunnar.schmitz |
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External electrostatic field
Started by djelenfi |
0 Replies
2634 Views |
February 17, 2020, 08:22:41 PM by djelenfi |
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Usage of momdrv in ricc2 module
Started by dojha |
1 Replies
3202 Views |
July 06, 2023, 01:46:32 PM by christof.haettig |
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1 Replies
4648 Views |
July 06, 2023, 02:27:21 PM by christof.haettig |
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COSMO in RI-CC2 Calculations
Started by dpleft |
2 Replies
3151 Views |
June 27, 2023, 06:49:21 PM by dpleft |
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fortran read error in CCSD(T)
Started by enolate |
0 Replies
7237 Views |
June 19, 2012, 11:41:37 PM by enolate |
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1 Replies
5351 Views |
May 07, 2015, 01:34:04 AM by Rafał Bachorz |
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1 Replies
5233 Views |
September 25, 2015, 01:43:21 PM by christof.haettig |
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Performance of ricc2 in a multicore case
Started by evgeniy |
1 Replies
6362 Views |
September 28, 2009, 11:27:44 AM by christof.haettig |
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CC2 vs MP2
Started by evgeniy |
0 Replies
6033 Views |
December 15, 2011, 07:50:41 PM by evgeniy |
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Is "ricc2 -fanal" working in TM-6.0?
Started by evgeniy |
14 Replies
14105 Views |
March 19, 2010, 03:06:02 PM by evgeniy |
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2 Replies
5546 Views |
March 24, 2024, 05:37:46 PM by christof.haettig |
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1 Replies
4575 Views |
July 06, 2023, 02:29:21 PM by christof.haettig |
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