qmcpack

History

Jaron Krogel c2d12af7ae Add pseudopotentials_for_tests and fix broken symlinks		2018-05-04 10:59:47 -04:00
..
converter	Fixed molecular H5 files to the latest version of builder	2018-03-26 01:57:37 -05:00
coverage	Handle the negative count coverage case.	2018-03-14 10:54:08 -05:00
estimator	Output more information for estimator failures	2017-06-09 15:01:18 -05:00
heg	add test for J2 RPA	2018-02-08 10:20:00 -05:00
io	Add checkpoint/restart tests to the coverage base	2017-06-21 23:06:06 -05:00
models	Remove unneeded files from qmc-ref	2018-05-02 13:00:56 -05:00
molecules	Add pseudopotentials_for_tests and fix broken symlinks	2018-05-04 10:59:47 -04:00
performance	Remove KEcorr in NiO performance test input files.	2018-03-28 10:34:54 -05:00
pseudopotentials_for_tests	Add pseudopotentials_for_tests and fix broken symlinks	2018-05-04 10:59:47 -04:00
pw2qmcpack	Fix pw2qmcpack tests.	2018-03-29 09:53:26 -05:00
solids	Add guard for hybridrep in tests.	2018-04-23 19:01:08 -05:00
test_automation	Update scripts	2018-04-27 17:23:49 -04:00
CMakeLists.txt	add test for J2 RPA	2018-02-08 10:20:00 -05:00
README	Enable plane wave tests for bccH. Only uses 100 blocks vs 1000 for spline case.	2016-12-18 22:52:18 +00:00

README

These directories contain input files for the automated test
system. They are not intended to be run separately although any
QMCPACK inputs should run to completion when run from the same
directory as the input, e.g. mpirun -n 16 qmcpack vmc.in.xml

To run the automated tests, from the build directory, run

ctest -R short

for the short running tests. These take a few minutes to run on a 16
core machine. To run all tests simply run

ctest

Running all tests requires several hours due to strict statistics. You
can increase verbosity with "ctest -V".

The test definitions and configuration are in
src/tests/system/CMakeLists.txt