The present study used a blend of biofuel and nanoparticles to examine the effectiveness and emission properties of a four-stroke, single-cylinder, direct-injection diesel engine with an injection pressure of 250 bar. The use of MoO3 in biodiesel enhances its environmental sustainability and dependability, making it a promising substitute for traditional diesel fuel. The study emphasises the ecological advantages of using a combination of coconut oil and MoO3 to accomplish the production of renewable energy. MoO3 nanoparticles ultimately function as an oxidation catalyst, enhancing combustion. A study with MoO3 nanoparticles at 50 and 100 ppm concentrations was carried out. Utilising a photo spectrometer, stability was determined. The CI engine demonstrated improved thermal efficiency and reduced Fuel Consumption compared to diesel, both at full load conditions and at 64.5 bar pressure. The performance, combustion, and emission parameters were precisely forecasted using Design Expert, exhibiting a robust connection with the testing results. The Rb values for Brake Specific Fuel Consumption (BSFC), Brake Thermal Efficiency (BTE), Peak Cylinder Pressure (P-CA), Net Heat Release Rate (NHRR), Crankcase Heat Release Rate (CHRR), Carbon Monoxide (CO), Unburned Hydrocarbons (UHC), Nitrogen Oxides (NOX), and Smoke Opacity are 0.997, 0.9998, 0.8898, 0.979, 0.9838, 0.9815, 0.9917, 0.9958, and 0.9261 respectively.
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