Comparing GIPAW with numerically exact chemical shieldings: The role of two-center contributions to the induced current

Authors :: Wijs, Gilles A. de
Kresse, G.
Havenith, R.W.A
Marsman, M.
Wijs, Gilles A. de
Kresse, G.
Havenith, R.W.A
Marsman, M.
Source :: Journal of Chemical Physics; 1; 9; 0021-9606; 23; 155; 234101; ~Journal of Chemical Physics~1~9~~~0021-9606~23~155~~234101
Publication Year :: 2021
Abstract: Contains fulltext : 246828.pdf (Publisher’s version ) (Closed access)

Database :: OAIster
Journal :: Journal of Chemical Physics; 1; 9; 0021-9606; 23; 155; 234101; ~Journal of Chemical Physics~1~9~~~0021-9606~23~155~~234101
Publication Type :: Electronic Resource
Accession number :: edsoai.on1298386643
Document Type :: Electronic Resource

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