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periodic boundary conditions
Started by asaf |
2 Replies
7179 Views |
August 29, 2011, 06:47:02 PMby pski |
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B2-PLYP never works
Started by Arrepiadd |
1 Replies
8565 Views |
February 22, 2008, 11:15:51 AM by antti_karttunen |
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8 Replies
15727 Views |
May 09, 2008, 05:22:57 PM by uwe |
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2 Replies
10194 Views |
August 22, 2007, 02:30:01 PM by antti_karttunen |
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problems with jobex convcheck.f
Started by annaamat |
1 Replies
9100 Views |
March 25, 2008, 11:18:08 AM by uwe |
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0 Replies
6486 Views |
September 09, 2008, 10:48:09 PM by Alex2007 |
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minimum energey crossing point (mecp)
Started by adam.kubas |
0 Replies
7083 Views |
September 13, 2009, 11:37:19 AM by adam.kubas |
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Optimized geometry
Started by 175116 |
6 Replies
17687 Views |
May 07, 2013, 08:47:07 PM by Turboooo |
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