Efficient Embedded Cluster Density Approximation Calculations with an Orbital-Free Treatment of Environments
- Award ID(s):
- 1752769
- PAR ID:
- 10319483
- Date Published:
- Journal Name:
- Journal of Chemical Theory and Computation
- Volume:
- 17
- Issue:
- 5
- ISSN:
- 1549-9618
- Format(s):
- Medium: X
- Sponsoring Org:
- National Science Foundation
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Accepted Manuscript1.0
- Journal Article:
- https://doi.org/10.1021/acs.jctc.0c01133
