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A computational fluid dynamics (CFD) guided design optimization was conducted for the piston bowl geometry for a heavy-duty diesel engine. The optimization goal was to minimize engine-out NOx emissions without sacrificing engine peak power and thermal efficiency. The CFD model was validated with experiments and the combustion system optimization was conducted under three selected operating conditions representing low speed, maximum torque, and rated power. A hundred piston bowl shapes were generated, of which 32 shapes with 3 spray angles for each shape were numerically analyzed and one optimized design of piston bowl geometry with spray angle was selected. On average, the optimized combustion system decreased nitrogen oxide (NOx) emissions by 17% and soot emissions by 41% without compromising maximum engine power and fuel economy.