Ticket List/Search - MolDS

ID	오픈 날짜	마지막 업데이트	요약	소유자	Reporter	Type	MileStone	Priority	Severity	Status	Resolution
36474	2016-07-22 17:19	2016-07-22 17:27	bug in calculating mulliken in excited states 2	mikiya_fujii	mikiya_fujii	Bugs	ver0.4.0	5 - Medium	9 - Highest	Closed	Fixed
36466	2016-07-16 21:56	2016-07-20 12:56	mullikens	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	None
35998	2016-01-28 22:15	2016-01-28 22:37	Avoiding degenerate MO energy	mikiya_fujii	mikiya_fujii	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
35142	2015-05-13 10:47	2016-01-19 18:14	tunig supported by RIST		mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
35100	2015-05-01 11:41	2015-05-06 14:16	tunig of loadbalance for half triangle matrix	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
35088	2015-04-28 00:37	2015-04-28 04:28	parallel drawing of electron and hole densities	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
35085	2015-04-25 16:39	2015-04-27 09:54	parallel drawing of MOs	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
35081	2015-04-24 00:29	2015-04-24 00:58	negative value for hole-plot	mikiya_fujii	mikiya_fujii	Patches	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
34694	2014-12-12 11:35	2015-04-24 17:18	second derivative (numerical)	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
34062	2014-07-21 18:35	2014-07-21 18:51	Use GEDIIS superposed force to calculate RFO step	ktns	ktns	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
34060	2014-07-21 02:08	2014-07-21 02:10	Fix compilation problem with GCC 4.9	ktns	ktns	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
34049	2014-07-16 03:19	2014-07-16 03:20	bug in mpi/AsyncCommunicator.h	mikiya_fujii	mikiya_fujii	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
34045	2014-07-15 10:49	2014-07-15 20:27	Space fixed atoms in optimization	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
33724	2014-04-29 11:22	2014-04-29 14:02	Enable atoms for adding bare VdW.	mikiya_fujii	mikiya_fujii	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
33722	2014-04-29 02:29	2014-04-29 10:19	Add Cl (chlorine)	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
33721	2014-04-29 01:26	2014-04-29 01:28	Add F (Fluorine)	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
33050	2014-01-30 13:34	2014-02-20 18:34	Sum of charge of a part of moleule	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
32884	2014-01-10 18:31	2014-01-10 19:05	Oscillator Strength	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
32883	2014-01-10 18:25	2014-01-10 19:11	-lboost_system is added in BOOST_LIBS in makefiles.	mikiya_fujii	mikiya_fujii	Bugs	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
32881	2014-01-10 16:59	2014-07-21 13:03	Refactor Optimizer classes using OptimizerState	ktns	ktns	Patches	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
32469	2013-11-22 02:30	2013-12-19 10:48	environmental point charges	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Open	None
31916	2013-08-24 01:22	2016-01-28 22:39	Scalapck to diagonalize HF matrix	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Closed	Fixed
31814	2013-07-31 16:15	2014-04-24 19:19	MPI-parallelization	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	7	Open	None
28791	2012-06-19 17:58	2013-12-19 09:12	Semiclassical method (NASCO)	mikiya_fujii	mikiya_fujii	Feature Requests	ver0.4.0	5 - Medium	5 - Medium	Open	None

MolDS

Ticket List (24 matches)