Nonadiabatic Molecular Dynamics with Extended Density Functional Tight-Binding: Application to Nanocrystals and Periodic Solids
- Award ID(s):
- 1931366
- NSF-PAR ID:
- 10392752
- Date Published:
- Journal Name:
- Journal of Chemical Theory and Computation
- Volume:
- 18
- Issue:
- 9
- ISSN:
- 1549-9618
- Page Range / eLocation ID:
- 5157 to 5180
- Format(s):
- Medium: X
- Sponsoring Org:
- National Science Foundation
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