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How to solve SCF convergence problems 2
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uwe
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2105
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September 04, 2009, 10:49:40 AM
by uwe
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Constrained optimization / scan along internal coordinates
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uwe
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5609
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April 30, 2008, 03:29:23 PM
by uwe
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How to solve SCF convergence problems
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uwe
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2334
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April 25, 2008, 03:20:45 PM
by uwe
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Parallel ricc2 stops with I/O error message
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uwe
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0
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2981
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August 06, 2007, 03:06:41 PM
by uwe
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I get "Segmentation Fault", SIGSEGV or "Memory fault"
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uwe
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3856
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February 05, 2007, 02:23:37 PM
by uwe
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With parallel Linux version, only one node is used as client ...
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turbomaster
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2125
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December 17, 2006, 12:36:20 PM
by turbomaster
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Define fails to generate a full set of internal coordinates ...
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turbomaster
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0
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1764
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December 17, 2006, 12:34:53 PM
by turbomaster
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RELAX error "force constant matrix will be read from $forceapprox ..." ...
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turbomaster
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0
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1678
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December 17, 2006, 12:33:57 PM
by turbomaster
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RIDFT and "MISSING BASIS SET SPECIFICATION(S) IN $atoms" error message ...
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turbomaster
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0
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1644
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December 17, 2006, 12:32:15 PM
by turbomaster
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RELAX stops with an error "keyword $intdef missing in file" ...
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turbomaster
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0
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1705
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December 17, 2006, 12:30:57 PM
by turbomaster
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After running RIDFT once, I resorted the atoms in $coord ...
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turbomaster
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0
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1678
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December 17, 2006, 12:26:08 PM
by turbomaster
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The JOBEX script does not stop, although energy and gradient are converged.
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turbomaster
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1698
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December 17, 2006, 12:24:48 PM
by turbomaster
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The test suite script TTEST does not work.
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turbomaster
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0
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1684
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December 17, 2006, 12:20:05 PM
by turbomaster
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Which builders can be used for Turbomole?
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turbomaster
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0
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1792
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December 17, 2006, 12:18:06 PM
by turbomaster
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Which viewers can be used with Turbomole?
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turbomaster
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0
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2197
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December 17, 2006, 12:17:25 PM
by turbomaster
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