Computational NMR: from semiempirical spectral simulations to advanced ab initio calculations

Computational NMR: from semiempirical spectral simulations to advanced ab initio calculations Full article

Journal

International Reviews in Physical Chemistry
ISSN: 0144-235X , E-ISSN: 1366-591X

Output data

Year: 2023, Volume: 42, Number: 1-4, Pages: 53-118 Pages count : 66 DOI: 10.1080/0144235x.2025.2529116

Authors

Rusakova Irina L. ¹ , Krivdin Leonid B. ¹

Affiliations

1	A.E. Favorsky Irkutsk Institute of Chemistry, Siberian Branch of the Russian Academy of Sciences

Rusakova I.L. , Krivdin L.B.
Computational NMR: from semiempirical spectral simulations to advanced ab initio calculations
International Reviews in Physical Chemistry. 2023. V.42. N1-4. P.53-118. DOI: 10.1080/0144235x.2025.2529116 WOS Scopus OpenAlex

≡ Web of science:	WOS:001530055600001
≡ Scopus:	2-s2.0-105010855724
≡ OpenAlex:	W4413092626