Derivation and implementation of the optical rotation tensor for chiral crystals
Author(s) -
Ty Balduf,
Marco Caricato
Publication year - 2022
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/5.0130385
Subject(s) - tensor (intrinsic definition) , density functional theory , correctness , dipole , polarizability , optical rotation , quadrupole , basis set , physics , computational chemistry , theoretical physics , quantum mechanics , mathematics , molecule , chemistry , geometry , algorithm , optics
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