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How thermochemistry of reactions, LHV etc. are explained to starters?

 by  Maryam Hussain

The heat of formation:

The enthalpy of formation, also known as the heat of formation, of a compound is the heat involved in its formation from its constituent elements. The enthalpies of the formation of elements are assumed to be zero. Thus, for the special case of the heat reaction of a chemical reaction, the heat of formation, and enthalpies of each of the terms on the left-hand side of the chemical equation are zero, and the heat of reaction becomes equal to the heat of formation of the given compound.

The standard heat of formation of a chemical compound is the enthalpy change when one g-mole of a specie at 25°C and 1 atm is formed from its elements in their naturally occurring states. Heats of formation of compounds are always expressed with reference to a standard state.

The molal heat of the formation of a compound represents the heat of reaction, ΔoHf (kJ/mol), when 1 mole of the compound is formed from the elements in a reaction & the reaction beginning and ending at 25°C and at a pressure of 1 atmosphere with the reacting elements are in the stable states at these conditions of temperature and pressure.

The heat of the formation of a compound is positive when its formation from the elements is accompanied by an increase in enthalpy of the formed compound. If the heat of the formation of a compound is positive, it is called an endothermic compound. In the same way, a compound whose heat of formation is negative is called an exothermic compound.

The heat of reaction:

The heat of reaction, ΔHr, is the enthalpy change for a chemical reaction in which stoichiometric quantities of reactants at temperature T and pressure P react completely (here completely means 100% conversion of reactants into products) to form products at the same temperature and pressure.

The standard heat of reaction, denoted by ΔHro, is defined as the difference between the enthalpies of the products in their standard states and of the reactants in their standard states, all at the same temperature; the standard conditions being 25°C and 1 atm.

Consider the reaction

A + B → R + S

For this reaction, the heat of the reaction may be calculated as

ΔHr  =  ΔHfR + ΔHfS   -  ΔHfA  -  ΔHfB

The heat of reaction is dependent not only on the chemical nature of each reacting material and product but also on their physical states. To define a heat of reaction, it is necessary to specify completely the nature and physical state (solid, liquid, gas) of each material involved.

The formula of a substance appearing in an equation designates not only the nature of the substance but also the quantity which is involved in the reaction. Thus, H3PO4 indicates 1 mole of phosphoric acid, and 1.5N2 indicates 1.5 moles of nitrogen.

With an irreversible reaction, all equations are written with the reactants on the left and the products on the right side. The value of the heat of reaction accompanying an equation is the heat of reaction when the reaction proceeds from the left to the right of the equation as written. If the reaction proceeds in the reverse direction the heat of the reaction is of opposite sign.

 The heating value of fuel:

There are two methods of expressing heating values and these differ in the state selected for the water present in the system after combustion.

The total heating value or higher heating value or gross calorific value of a fuel is the heat evolved in its complete combustion under constant pressure at a temperature of 18°C when all the water formed and the water originally present as a liquid in the fuel is condensed to the liquid state.

The net heating value or lower heating value or gross calorific value is similarly defined except that the final state of the water in the system after combustion is taken as vapor at 18°C. The net heating value is obtained from the total heating value by subtracting the latent heat of vaporization at 18°C of the water formed and vaporized in the combustion. Recent methods for determining any of these heating values, operate the system at 1-atmosphere pressure and 25 oC Celsius temperature.

The relative energies of the products to the reactants determine whether the chemical reaction is an exothermic reaction (gives off heat to its surroundings) or an endothermic reaction (absorbs heat from its surroundings).

In a reaction between molecules, energy is required to break the reactant chemical bonds, and energy is released when the product bonds form. If the energy required to break the reactant chemical bonds is lesser than the energy when the product bonds are formed & energy is released (as in the water formation reaction), the reaction is called an exothermic reaction. In an exothermic reaction, the product molecules, at a given temperature and pressure, have lower internal energies (and hence lower enthalpies) than the reactant molecules at the same temperature and pressure.

Note: If a chemical reaction is highly exothermic, the released heat can lead to unsafe temperature rises. Diluting the reactants with a carrier gas such as nitrogen is one way of controlling the resulting temperature increase.

The heat of combustion:

The heat of combustion and the heating value of a fuel is the same in the definition. The heat of combustion may be reported as either net heating value (lower heating value, LHV) or gross heating value (higher heating value, HHV).

To differentiate between the two, reconsider the chemical equation for methane combustion. Burring of methane produces two products: CO2 and H2O. The CO2 will remain a gas under all industrial combustion conditions. However, H2O, and alike compounds, can exist as either a liquid or a vapor, depending on how much heat is extracted from the process. If so much heat is removed from the system, while the system is maintained at 25 oC, that the H2O condenses, then the combustion yields its HHV. If water is released from the stack as a vapor, then combustion yields the LHV at 25 oC.

The process industry usually uses the LHV. Boiler and turbine calculations usually use the HHV.

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