← F0001: A g-xTB benchmark set of 29,833 Reaction-QM transition states for testing reaction-path searches
F0001 · Version 1 · Files
reproduce/
| Name | Size |
|---|---|
../ | |
build_tables.py | 6.0 KB |
figures.py | 1.1 KB |
quick_rerun.py | 3.5 KB |
README.md | 2.1 KB |
rerun/ |