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0507296 - ÚOCHB 2020 RIV GB eng J - Journal Article
Fukal, Jiří - Páv, Ondřej - Buděšínský, Miloš - Rosenberg, Ivan - Šebera, Jakub - Sychrovský, Vladimír
Structural interpretation of the 31P NMR chemical shifts in thiophosphate and phosphate: key effects due to spin-orbit and explicit solvent.
Physical Chemistry Chemical Physics. Roč. 21, č. 19 (2019), s. 9924-9934. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR(CZ) GA19-13436S
Institutional support: RVO:61388963
Keywords : correlated molecular calculations * density functional methods * Gaussian basis sets
OECD category: Physical chemistry
Impact factor: 3.430, year: 2019
Method of publishing: Limited access
https://pubs.rsc.org/en/content/articlelanding/2019/CP/C9CP01460H#!divAbstract
Permanent Link: http://hdl.handle.net/11104/0298312