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The kilocalorie per mole is a unit to measure an amount of energy per number of molecules, atoms, or other similar particles. It is defined as one kilocalorie of energy (1000 thermochemical gram calories) per one mole of substance. The unit symbol is written kcal/mol or kcal⋅mol −1. As typically measured, one kcal/mol represents a ...
kT (also written as k B T) is the product of the Boltzmann constant, k (or k B), and the temperature, T.This product is used in physics as a scale factor for energy values in molecular-scale systems (sometimes it is used as a unit of energy), as the rates and frequencies of many processes and phenomena depend not on their energy alone, but on the ratio of that energy and kT, that is, on E ...
The hartree (symbol: E h), also known as the Hartree energy, is the unit of energy in the atomic units system, named after the British physicist Douglas Hartree.Its CODATA recommended value is E h = 4.359 744 722 2060 (48) × 10 −18 J [1] = 27.211 386 245 981 (30) eV.
Boltzmann constant: The Boltzmann constant, k, is one of seven fixed constants defining the International System of Units, the SI, with k = 1.380 649 x 10 −23 J K −1.The Boltzmann constant is a proportionality constant between the quantities temperature (with unit kelvin) and energy (with unit joule).
In physics, ionization energy is usually expressed in electronvolts (eV) or joules (J). In chemistry, it is expressed as the energy to ionize a mole of atoms or molecules, usually as kilojoules per mole (kJ/mol) or kilocalories per mole (kcal/mol). [3]
In the Arrhenius model of reaction rates, activation energy is the minimum amount of energy that must be available to reactants for a chemical reaction to occur. [1] The activation energy (E a) of a reaction is measured in kilojoules per mole (kJ/mol) or kilocalories per mole (kcal/mol). [2]
R ∗ = 8.314 32 × 10 3 N⋅m⋅kmol −1 ⋅K −1 = 8.314 32 J⋅K −1 ⋅mol −1. Note the use of the kilomole, with the resulting factor of 1000 in the constant. The USSA1976 acknowledges that this value is not consistent with the cited values for the Avogadro constant and the Boltzmann constant. [ 13 ]
Other units sometimes used to describe reaction energetics are kilocalories per mole (kcal·mol −1), electron volts per particle (eV), and wavenumbers in inverse centimeters (cm −1). 1 kJ·mol −1 is approximately equal to 1.04 × 10 −2 eV per particle, 0.239 kcal·mol −1, or 83.6 cm −1.