Open AccessOptical properties of $$\hbox {Ag}_{29}$$(BDT)$$_{12}$$(TPP)$$_4$$ in the VIS and UV and influence of ligand modeling based on real-time electron dynamics
Author(s) -
Rajarshi Sinha-Roy,
Xóchitl López-Lozano,
Robert L. Whetten,
HansChristian Weissker
Publication year - 2021
Publication title -
theoretical chemistry accounts
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.431
H-Index - 108
eISSN - 1432-881X
pISSN - 1432-2234
DOI - 10.1007/s00214-021-02783-4
Subject(s) - chemistry , ligand (biochemistry) , time dependent density functional theory , benzene , absorption spectroscopy , density functional theory , molecule , visible spectrum , absorption (acoustics) , spectral line , cluster (spacecraft) , crystallography , photochemistry , computational chemistry , physics , optics , organic chemistry , receptor , biochemistry , computer science , astronomy , programming language
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