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Page 1
Ab Initio Dot Structures Beyond the Lewis Picture.
Molecules. 2021 Feb 9;26(4):911. doi: 10.3390/molecules26040911.
Molecules. 2021.
PMID: 33572207
Free PMC article.
Integrated Reaction Path Processing from Sampled Structure Sequences.
Heuer MA, Vaucher AC, Haag MP, Reiher M.
Heuer MA, et al.
J Chem Theory Comput. 2018 Apr 10;14(4):2052-2062. doi: 10.1021/acs.jctc.8b00019. Epub 2018 Mar 23.
J Chem Theory Comput. 2018.
PMID: 29518323
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