Axel Kohlmeyer 4f44159d56 add a test for r-RESPA (only with newton on and for plain styles for now)

2020-05-21 11:17:49 -04:00

..

tests

tweak error margin

2020-05-21 01:30:04 -04:00

angle_style.cpp

only collect the per-atom data specific to this test to compare against total pe.

2020-05-21 11:06:11 -04:00

bond_style.cpp

only collect the per-atom data specific to this test to compare against total pe.

2020-05-21 11:06:11 -04:00

CMakeLists.txt

build common unit test sources into a static library and link with it

2020-05-20 07:32:32 -04:00

error_stats.cpp

add unit test framework for pair, bond, angle styles from progguide branch

2020-05-19 22:24:31 -04:00

error_stats.h

add unit test framework for pair, bond, angle styles from progguide branch

2020-05-19 22:24:31 -04:00

pair_style.cpp

add a test for r-RESPA (only with newton on and for plain styles for now)

2020-05-21 11:17:49 -04:00

test_config_reader.cpp

Fix indentation

2020-05-20 02:48:02 -04:00

test_config_reader.h

add unit test framework for pair, bond, angle styles from progguide branch

2020-05-19 22:24:31 -04:00

test_config.h

add unit test framework for pair, bond, angle styles from progguide branch

2020-05-19 22:24:31 -04:00

test_main.cpp

add option to test main program to override the value of the INPUT_FOLDER variable

2020-05-20 15:23:32 -04:00

test_main.h

move definition of the INPUT_FOLDER variable from header to implementation file

2020-05-20 15:22:43 -04:00

yaml_reader.h

cosmetic changes for consistent source formatting

2020-05-20 07:40:37 -04:00

yaml_writer.cpp

cosmetic changes for consistent source formatting

2020-05-20 07:40:37 -04:00

yaml_writer.h

cosmetic changes for consistent source formatting

2020-05-20 07:40:37 -04:00