| Subject / Started by | Replies / Views  |
Last post | ||
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problem in ired
Started by jitmukherjeechem |
3 Replies
7955 Views |
May 22, 2012, 09:55:54 AMby Arnim |
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5 Replies
7824 Views |
September 10, 2018, 09:45:45 PM by uwe |
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setting for rimp2 caculation with ricc2
Started by YangSiYa |
3 Replies
7758 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
7748 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
7735 Views |
April 06, 2013, 12:26:04 PM by Arnim |
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2 Replies
7611 Views |
April 15, 2008, 07:19:17 PM by FKoehler |
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weird_eht_2nd
Started by Kiwinator |
1 Replies
7473 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
7447 Views |
November 19, 2010, 11:08:48 AM by uwe |
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binary mos error
Started by Daniel |
1 Replies
7391 Views |
March 19, 2008, 03:54:26 PM by Daniel |
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2 Replies
7358 Views |
June 03, 2008, 10:26:34 AM by evgeniy |
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flip @ define
Started by chburger |
2 Replies
7300 Views |
March 25, 2008, 11:07:33 AM by uwe |
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heavy atoms without ecp
Started by fru14909 |
4 Replies
7240 Views |
March 02, 2021, 12:31:33 PM by Scoops |
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Turbomole parallel error
Started by kshatresh |
1 Replies
7233 Views |
February 01, 2018, 03:56:34 PM by uwe |
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How to use "scanprep" script?
Started by ztehrani |
1 Replies
7221 Views |
May 16, 2017, 04:21:20 PM by Arnim |
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2 Replies
7209 Views |
April 09, 2016, 11:18:00 AM by inozerox |
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Reading a weird basis set
Started by Kiwinator |
2 Replies
7180 Views |
January 08, 2009, 03:54:10 PM by Kiwinator |
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0 Replies
7166 Views |
September 04, 2010, 02:28:33 PM by wuhen |
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4 Replies
7120 Views |
August 23, 2018, 12:28:46 PM by evgeniy |
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cant find all internal coordinates
Started by janwahl |
2 Replies
7040 Views |
September 07, 2009, 12:36:25 PM by janwahl |
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setting ECPs: define vs TmoleX
Started by ekirillov |
1 Replies
7021 Views |
November 24, 2009, 10:48:02 AM by christof.haettig |
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