Presentation Information

[14p-P07-45]Application of Hybrid Density Functional Tight Binding (DFTB)-Molecular Mechanics Approach to Computing Optical Properties of Dyes on Nanoparticles

〇(D)Tengxiang Li1, Ruicheng Li1, Keisuke Kameda1, Sergei Manzhos1, Manabu Ihara1 (1.Inst. Sci. Tokyo)

Keywords:

DFT,DFTB,nanoparticle


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