JAX-ReaxFF: A Gradient-Based Framework for Fast Optimization of Reactive Force Fields
- Award ID(s):
- 1807740
- NSF-PAR ID:
- 10386916
- Date Published:
- Journal Name:
- Journal of Chemical Theory and Computation
- Volume:
- 18
- Issue:
- 9
- ISSN:
- 1549-9618
- Page Range / eLocation ID:
- 5181 to 5194
- Format(s):
- Medium: X
- Sponsoring Org:
- National Science Foundation
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