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problem in ired
Started by jitmukherjeechem |
3 Replies
8050 Views |
May 22, 2012, 09:55:54 AMby Arnim |
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ired problem
Started by 175116 |
3 Replies
8036 Views |
November 06, 2010, 09:21:06 PM by 175116 |
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Turbomole parallel error
Started by kshatresh |
1 Replies
7929 Views |
February 01, 2018, 03:56:34 PM by uwe |
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2 Replies
7912 Views |
April 09, 2016, 11:18:00 AM by inozerox |
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How to use "scanprep" script?
Started by ztehrani |
1 Replies
7898 Views |
May 16, 2017, 04:21:20 PM by Arnim |
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setting for rimp2 caculation with ricc2
Started by YangSiYa |
3 Replies
7882 Views |
February 05, 2009, 02:22:12 PM by christof.haettig |
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On the def2-SV(P) basis sets
Started by evgeniy |
1 Replies
7857 Views |
April 07, 2008, 10:26:25 AM by Arnim |
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frozen core and full core calculations
Started by golden |
4 Replies
7838 Views |
April 06, 2013, 12:26:04 PM by Arnim |
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4 Replies
7799 Views |
August 23, 2018, 12:28:46 PM by evgeniy |
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2 Replies
7692 Views |
April 15, 2008, 07:19:17 PM by FKoehler |
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weird_eht_2nd
Started by Kiwinator |
1 Replies
7555 Views |
February 13, 2008, 06:41:58 AM by uwe |
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Up to a million dummy atoms
Started by Zessin |
3 Replies
7516 Views |
November 19, 2010, 11:08:48 AM by uwe |
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1 Replies
7484 Views |
January 18, 2019, 05:26:31 PM by uwe |
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binary mos error
Started by Daniel |
1 Replies
7460 Views |
March 19, 2008, 03:54:26 PM by Daniel |
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B-p86 functional in Turbomole
Started by zahra |
2 Replies
7457 Views |
February 17, 2017, 12:15:23 PM by zahra |
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2 Replies
7426 Views |
June 03, 2008, 10:26:34 AM by evgeniy |
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4 Replies
7383 Views |
August 15, 2018, 06:15:42 PM by uwe |
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flip @ define
Started by chburger |
2 Replies
7370 Views |
March 25, 2008, 11:07:33 AM by uwe |
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heavy atoms without ecp
Started by fru14909 |
4 Replies
7355 Views |
March 02, 2021, 12:31:33 PM by Scoops |
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Reading a weird basis set
Started by Kiwinator |
2 Replies
7288 Views |
January 08, 2009, 03:54:10 PM by Kiwinator |
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