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The nanoparticles’ localized surface plasmon resonance (LSPR) is sensitive to the surrounding medium refractive index change. Therefore, biosensing devices commonly use it as a refractive index-based sensor. In this work, an improvement strategy for the sensing performance of gold (Au) and silver (Ag) ellipsoid nanoparticles (NP-ELs) through controlling the size, aspect ratio (AR), and core–shell structure was proposed. The investigation was started by constructing a multiple oscillator model to derive the optical permittivity function and compute the absorption of nanoparticles via discrete dipole approximation (DDA). The change in position and width of the LSPR peak concerning the refractive index of the medium were calculated to determine the sensing performance. Sensitivity and figure of merit (FOM) were used to describe the sensing performance. As a result, the AR parameter of nanoparticles was found to …