Ab Initio Multiple Spawning Nonadiabatic Dynamics with Different CASPT2 Flavors: A Fully Open-Source PySpawn/OpenMolcas Interface
- Award ID(s):
- 1954519
- PAR ID:
- 10559958
- Publisher / Repository:
- ACS
- Date Published:
- Journal Name:
- Journal of Chemical Theory and Computation
- ISSN:
- 1549-9618
- Format(s):
- Medium: X
- Sponsoring Org:
- National Science Foundation
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