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1 Replies
6004 Views |
November 18, 2010, 06:14:50 PMby christof.haettig |
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1 Replies
6064 Views |
January 20, 2011, 02:33:01 PM by christof.haettig |
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0 Replies
4643 Views |
April 21, 2011, 04:08:40 PM by pandaaka |
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0 Replies
5253 Views |
July 13, 2011, 03:49:12 PM by Hasan |
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0 Replies
6924 Views |
July 14, 2011, 02:51:03 PM by greisen |
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1 Replies
7383 Views |
August 12, 2011, 09:43:25 AM by christof.haettig |
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Calculation of Multiplicity with Turbomole
Started by Lara |
1 Replies
5567 Views |
March 17, 2012, 05:30:13 PM by Arnim |
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does the .cube write work at all?
Started by sampsa |
3 Replies
7997 Views |
March 20, 2012, 03:20:35 PM by JanM |
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B3LYP orbitals
Started by tayed |
0 Replies
4911 Views |
April 12, 2012, 05:08:52 PM by tayed |
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0 Replies
5285 Views |
May 02, 2012, 10:44:58 AM by Konstantin |
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1 Replies
7665 Views |
May 29, 2012, 12:43:05 PM by e.berardo |
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0 Replies
6295 Views |
June 06, 2012, 05:16:54 AM by wuhen |
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1 Replies
5681 Views |
October 24, 2012, 07:43:55 PM by acapobia |
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how to calculate the spin natural orbital
Started by ardie |
0 Replies
5405 Views |
November 13, 2012, 01:35:05 PM by ardie |
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dipole moment
Started by shima |
1 Replies
7368 Views |
November 30, 2012, 08:37:05 AM by zelsan |
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Radius of Hydrogen used in $esp_fit kollman
Started by Hauke |
0 Replies
5537 Views |
December 14, 2012, 01:07:13 AM by Hauke |
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How generate wfn file in TM V6.3
Started by tayed |
4 Replies
11849 Views |
February 26, 2013, 07:52:04 PM by Hauke |
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12 Replies
13612 Views |
May 03, 2013, 09:23:27 AM by antti_karttunen |
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Mullikan Charges Confusing
Started by kmkumar |
2 Replies
9429 Views |
October 11, 2013, 04:35:28 PM by uwe |
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negative oscillator strengths
Started by vspata0 |
0 Replies
5790 Views |
November 21, 2013, 08:29:50 PM by vspata0 |
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