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minimum energey crossing point (mecp)
Started by adam.kubas |
0 Replies
7161 Views |
September 13, 2009, 11:37:19 AMby adam.kubas |
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Optimization error with symmetry
Started by ylniu |
0 Replies
6972 Views |
July 09, 2009, 09:09:12 AM by ylniu |
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0 Replies
6278 Views |
June 30, 2009, 07:29:34 AM by Guangyue |
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0 Replies
5925 Views |
June 19, 2009, 11:21:01 AM by evgeniy |
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metastase
Started by Matteo Guglielmi |
2 Replies
9799 Views |
February 27, 2009, 02:51:35 AM by Matteo Guglielmi |
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Turbomole in two different machines
Started by kmkumar |
1 Replies
6791 Views |
February 05, 2009, 03:29:58 PM by christof.haettig |
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1 Replies
7826 Views |
January 11, 2009, 12:58:30 PM by christof.haettig |
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1 Replies
7631 Views |
January 11, 2009, 12:17:23 PM by christof.haettig |
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Basic AIMD setup
Started by mpjohans |
1 Replies
7899 Views |
October 31, 2008, 03:43:11 PM by selliott |
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Triplet state optimization
Started by Beverly |
7 Replies
12121 Views |
October 02, 2008, 01:56:06 PM by Arnim |
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could not find file <uffhessian0-0>
Started by purplekey |
2 Replies
7730 Views |
September 27, 2008, 05:03:38 AM by purplekey |
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0 Replies
6570 Views |
September 09, 2008, 10:48:09 PM by Alex2007 |
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IRC calculation
Started by marcel |
0 Replies
7362 Views |
September 09, 2008, 10:28:17 PM by marcel |
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1 Replies
7954 Views |
July 02, 2008, 05:36:20 PM by uwe |
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Frozen Optimization
Started by lanjh |
1 Replies
7762 Views |
May 26, 2008, 11:30:25 AM by uwe |
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8 Replies
15849 Views |
May 09, 2008, 05:22:57 PM by uwe |
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0 Replies
7572 Views |
April 16, 2008, 02:19:34 PM by evgeniy |
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problems with jobex convcheck.f
Started by annaamat |
1 Replies
9189 Views |
March 25, 2008, 11:18:08 AM by uwe |
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checking number of negative eigenvalues
Started by gojimeo |
2 Replies
9501 Views |
February 28, 2008, 10:21:17 PM by gojimeo |
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B2-PLYP never works
Started by Arrepiadd |
1 Replies
8667 Views |
February 22, 2008, 11:15:51 AM by antti_karttunen |
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