sebastiankloth a38e601fcb Adjusted functions to work with new pbc_poits

2022-11-03 16:20:04 +01:00

..

__init__.py

Increased version

2022-06-08 15:12:59 +02:00

atoms.py

Initial version

2022-04-20 14:08:38 +02:00

autosave.py

Changed autosave

2022-11-03 14:17:28 +01:00

checksum.py

Initial version

2022-04-20 14:08:38 +02:00

cli.py

Initial version

2022-04-20 14:08:38 +02:00

coordinates.py

Initial version

2022-04-20 14:08:38 +02:00

correlation.py

Added hbonds function

2022-11-03 15:46:14 +01:00

distribution.py

Adjusted functions to work with new pbc_poits

2022-11-03 16:20:04 +01:00

functions.py

Initial version

2022-04-20 14:08:38 +02:00

logging.py

Initial version

2022-04-20 14:08:38 +02:00

pbc.py

Changed pbc_poits to general case

2022-11-03 16:05:22 +01:00

reader.py

Changed energy_reader genfromtxt to loadtxt

2022-05-25 16:39:41 +02:00

utils.py

Added hbonds function

2022-11-03 15:46:14 +01:00