Path integral computation of quantum free energy differences due to alchemical transformations involving mass and potential.
Journal Article
·
· Journal of Chemical Theory and Computation
OSTI ID:1110281
Abstract not provided.
- Research Organization:
- Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
- Sponsoring Organization:
- USDOE National Nuclear Security Administration (NNSA)
- DOE Contract Number:
- AC04-94AL85000
- OSTI ID:
- 1110281
- Report Number(s):
- SAND2011-0672J; 473722
- Journal Information:
- Journal of Chemical Theory and Computation, Related Information: Proposed for publication in Journal of Chemical Theory and Computation.
- Country of Publication:
- United States
- Language:
- English
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