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In this paper an online method for automatically reducing complex chemical mechanisms for simulations of combustion phenomena has been developed. The method is based on the Quasi Steady State Assumption (QSSA). In contrast to previous reduction schemes where chemical species are selected only when they are in steady state throughout the whole process, the present method allows for species to be selected at each operating point separately generating an adaptive chemical kinetics. The method is used for calculations of a natural gas fueled engine operating under Homogenous Charge Compression Ignition (HCCI) conditions. We discuss criteria for selecting steady state species and the influence of these criteria on the results such as concentration profiles and temperature.

Methanol is today considered a viable green fuel for combustion engines because of its low soot emissions and the possibility of it being produced in a CO2-neutral manner. Methanol as a fuel for combustion engines have attracted interest throughout history and much research was conducted during the oil crisis in the seventies. In the beginning of the eighties the oil prices began to decrease and interest in methanol declined. This paper presents the emission potential of methanol. T-Φ maps were constructed using a 0-D reactor with constant pressure, temperature and equivalence ratio to show the emission characteristics of methanol. These maps were compared with equivalent maps for diesel fuel. The maps were then complemented with engine simulations using a stochastic reactor model (SRM), which predicts end-gas emissions. The SRM was validated using experimental results from a truck engine running in Partially Premixed Combustion (PPC) mode at medium loads.

During cold start of natural gas engines, increased methane and formaldehyde emissions can be released due to flame quenching on cold cylinder walls, misfiring and the catalyst not being fully active at low temperatures. Euro 6 legislation does not regulate methane and formaldehyde emissions. New limits for these two pollutants have been proposed by CLOVE consortium for Euro 7 scenarios. These proposals indicate tougher requirements for aftertreatment systems of natural gas engines. In the present study, a zero-dimensional model for real-time engine-out emission prediction for transient engine cold start is presented. The model incorporates the stochastic reactor model for spark ignition engines and tabulated chemistry. The tabulated chemistry approach allows to account for the physical and chemical properties of natural gas fuels in detail by using a-priori generated laminar flame speed and combustion chemistry look-up tables.

Worldwide, there is the demand to reduce harmful emissions from non-road vehicles to fulfill European Stage V+ and VI (2022, 2024) emission legislation. The rules require significant reductions in nitrogen oxides (NOx), methane (CH4) and formaldehyde (CH2O) emissions from non-road vehicles. Compressed natural gas (CNG) engines with appropriate exhaust aftertreatment systems such as three-way catalytic converter (TWC) can meet these regulations. An issue remains for reducing emissions during the engine cold start where the CNG engine and TWC yet do not reach their optimum operating conditions. The resulting complexity of engine and catalyst calibration can be efficiently supported by numerical models. Hence, it is required to develop accurate simulation models which can predict cold start emissions. This work presents a real-time engine model for transient engine-out emission prediction using tabulated chemistry for CNG.

This paper focuses on the performance and efficiency of an HCCI (Homogenous Charge Compression Ignition) engine system running on natural gas or landfill gas for stationary applications. Zero dimensional modeling and simulation of the engine, turbo, inlet and exhaust manifolds and inlet air conditioner (intercooler/heater) are used to study the effect of compression ratio and exhaust turbine size on maximum mean effective pressure and efficiency. The extended Zeldovich mechanism is used to estimate NO-formation in order to determine operation limits. Detailed chemical kinetics is used to predict ignition timing. Simulation of the in-cylinder process gives a minimum λ-value of 2.4 for natural gas, regardless of compression ratio. This is restricted by the NO formation for richer mixtures. Lower compression ratios allow higher inlet pressure and hence higher load, but it also reduces indicated efficiency.

The Homogeneous Charge Compression Ignition (HCCI) is the third alternative for combustion in the reciprocating engine. Here, a homogeneous charge is used as in a spark ignited engine, but the charge is compressed to auto-ignition as in a diesel. The main difference compared with the Spark Ignition (SI) engine is the lack of flame propagation and hence the independence from turbulence. Compared with the diesel engine, HCCI has a homogeneous charge and hence no problems associated with soot and NOX formation. Earlier research on HCCI showed high efficiency and very low amounts of NOX, but HC and CO were higher than in SI mode. It was not possible to achieve high IMEP values with HCCI, the limit being 5 bar. Supercharging is one way to dramatically increase IMEP. The influence of supercharging on HCCI was therefore experimentally investigated. Three different fuels were used during the experiments: iso-octane, ethanol and natural gas.