Active Layer-Incorporated, Spectrally Tuned Au/SiO<sub>2</sub> Core/Shell Nanorod-Based Light Trapping for Organic Photovoltaics

Abstract

We demonstrate that incorporation of octadecyltrimethoxysilane (OTMS)-functionalized, spectrally tuned, gold/silica (Au/SiO<sub>2</sub>) core/shell nanospheres and nanorods into the active layer of an organic photovoltaic (OPV) device led to an increase in photoconversion efficiency (PCE). A silica shell layer was added onto Au core nanospheres and nanorods in order to provide an electrically insulating surface that does not interfere with carrier generation and transport inside the active layer. Functionalization of the Au/SiO<sub>2</sub> core/shell nanoparticles with the OTMS organic ligand was then necessary to transfer the Au/SiO<sub>2</sub> core/shell nanoparticles from an ethanol solution into an OPV polymer-compatible solvent, such as dichlorobenzene. The OTMS-functionalized Au/SiO<sub>2</sub> core/shell nanorods and nanospheres were then incorporated into the active layers of two OPV polymer systems: a poly(3-hexylthiophene):[6,6]-phenyl-C61-butyric acid methyl ester (P3HT:PCB<sub>60</sub>M) OPV device and a poly[2,6-4,8-di(5-ethylhexylthienyl)benzo[1,2-<i>b</i>;3,4-<i>b</i>]dithiophene-<i>alt</i>-5-dibutyloctyl-3,6-bis(5-bromothiophen-2-yl)pyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione] (PBDTT-DPP:PC<sub>60</sub>BM) OPV device. For the P3HT:PC<sub>60</sub>BM polymer with a band edge of ∼700 nm, the addition of the core/shell nanorods with an aspect ratio (AR) of ∼2.5 (extinction peak ∼670 nm) resulted in a 7.1% improvement in PCE, while for the PBDTT-DPP:PC<sub>60</sub>BM polymer with a band edge of ∼860 nm, the addition of core/shell nanorods with an AR of ∼4 (extinction peak ∼830 nm) resulted in a 14.4% improvement in PCE. The addition of Au/SiO<sub>2</sub> core/shell nanospheres to the P3HT:PC<sub>60</sub>BM polymer resulted in a 2.7% improvement in PCE, while their addition to a PBDTT-DPP:PC<sub>60</sub>BM polymer resulted in a 9.1% improvement. The PCE and <i>J</i><sub>sc</sub> enhancements were consistent with external quantum efficiency (EQE) measurements, and the EQE enhancements spectrally matched the extinction spectra of Au/SiO<sub>2</sub> nanospheres and nanorods in both OPV polymer systems

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