Bugs Maximize Restore

Showing 21 results of 21

# Summary Milestone Status Owner Created Updated
61 mpqc crashed with SIGABRT in sc::MPQCIn::error() mpqc2.3 open Edward Valeev 2013-01-21 2013-01-21  
59 "sc::DistArray4_MPIIOFile::clone" must not be declared as v None open 2012-03-29 2012-07-22  
57 two definitions of FinDispMolecularHessian that do not agree None open 2012-03-25 2012-07-22  
56 class "sc::AtomInfo::atom" is inaccessible mpqc/trunk open 2012-03-18 2012-07-22  
53 Problem compiling with libint2 mpqc2.4 open 2011-07-16 2012-07-22  
52 iterations to more than 100 mpqc2.4 open 2011-07-08 2012-07-22  
51 nij=0 when interatomic distance small None open 2011-06-01 2012-07-22  
49 mp2r12 test cases fail mpqc/trunk open Edward Valeev 2011-03-31 2012-07-22  
48 scdirlist.h polluted with unnecessary defines None open 2011-03-31 2012-07-22  
47 make check1 tries to run missing tests None open Curtis Janssen 2011-03-31 2012-07-22  
46 make check1 tries to run missing tests None open 2011-03-31 2012-07-22  
43 mp2 from computed wfn BAD_ACCESS mpqc/trunk open 2010-12-02 2012-07-22  
42 SCF: direct SCF or SCF with cached ERI? mpqc2.3 open 2010-09-02 2012-07-22  
41 Problem with MP2 optimisation on a Bluegene P machine mpqc/trunk open 2010-08-13 2012-07-22  
40 Check documentation of prerequisites mpqc/trunk open Curtis Janssen 2008-11-01 2012-07-22  
38 ARMCIMemoryGrp hangs when localsize==0 mpqc2.3 open 2007-08-20 2012-07-22  
37 Wavefunction(KeyVal) does not throw if basis is missing None open Edward Valeev 2007-07-24 2012-07-22  
36 Missing linkages in libSC* libraries None open 2007-05-18 2012-07-22  
35 Internal coordinate singularity None open Joseph P. Kenny 2006-08-24 2012-07-22  
34 missing link in the mpqc simple input doc. mpqc2.3 open 2006-04-27 2012-07-22  
22 timing bug with enhanced real time clock None open Joseph P. Kenny 2005-11-08 2012-07-22  
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