Oleg E. Peil ac46611e51 Fixed freezing issue in CSC run; better exception handling ... In some MPI implementations the self-consistent run of `sc_dmft.py` resulted in random freezings. This issue was fixed by polling the VASP lock file only on the master node. Also, better exception handling is implemented, allowing all nodes to exit properly in case of error.		2016-12-31 14:42:43 +01:00
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converters	Fixed freezing issue in CSC run; better exception handling	2016-12-31 14:42:43 +01:00
__init__.py	Moved U_matrix to TRIQS library	2015-06-17 18:19:30 +02:00
.gitignore	Reshuffled some files, added .gitignore	2015-10-21 11:54:22 +02:00
clear_h5_output.py	Fix subgroup name in clear_h5_output.py	2015-03-12 11:01:02 +01:00
CMakeLists.txt	Added a shell script for running PLOVasp converter	2016-03-11 11:35:19 +01:00
sumk_dft_tools.py	Adapt to complex g(tau)	2015-12-12 14:30:06 +01:00
sumk_dft.py	Fixed a bug in the calculation of the total energy	2016-05-10 11:48:28 +02:00
symmetry.py	Removes work around for issue #41	2015-08-10 16:14:51 +02:00
trans_basis.py	[doc] New documentation	2015-04-21 14:31:15 +02:00
update_archive.py	Unify notation in sumk_dft_tools.	2015-01-22 10:47:53 +01:00
version.py.in	Able to get dft_tools hash now	2016-02-07 10:43:23 +01:00