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How Do Self-Interaction Errors Associated with Stretched Bonds Affect Barrier Height Predictions?
- Source :
- The Journal of Physical Chemistry A. 127:1750-1759
- Publication Year :
- 2023
- Publisher :
- American Chemical Society (ACS), 2023.
- Subjects :
- Physical and Theoretical Chemistry
Subjects
Details
- ISSN :
- 15205215 and 10895639
- Volume :
- 127
- Database :
- OpenAIRE
- Journal :
- The Journal of Physical Chemistry A
- Accession number :
- edsair.doi...........fcc1e9a0218da60468edb42759462144
- Full Text :
- https://doi.org/10.1021/acs.jpca.2c07894