Open AccessMULTI-STATE EXTRAPOLATION OF UV/VIS ABSORPTION SPECTRA WITH QM/QM HYBRID METHODS
Author(s) -
Sijin Ren,
Marco Caricato
Publication year - 2017
Publication title -
ideals (university of illinois urbana-champaign)
Language(s) - English
Resource type - Conference proceedings
DOI - 10.15278/isms.2017.wi07
Subject(s) - qm/mm , extrapolation , absorption (acoustics) , spectral line , materials science , physics , chemistry , computational chemistry , optics , quantum mechanics , mathematics , molecular dynamics , mathematical analysis
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