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Transition state theory

Index Transition state theory

Transition state theory (TST) explains the reaction rates of elementary chemical reactions. [1]

48 relations: Arrhenius equation, Boltzmann constant, Chemical equilibrium, Chemical reaction, Collision theory, Curtin–Hammett principle, Dennis A. Dougherty, Enthalpy, Entropy of activation, Enzyme catalysis, Equilibrium constant, Eugene Wigner, Eyring equation, Gas constant, Gibbs free energy, Henry Eyring (chemist), Jacobus Henricus van 't Hoff, James Clerk Maxwell, Karl Herzfeld, Keith J. Laidler, Kinetic theory of gases, Leopold Pfaundler, Linus Pauling, Ludwig Boltzmann, Max Trautz, Maxwell–Boltzmann distribution, Meredith Gwynne Evans, Michael Polanyi, Molecular vibration, Nonadiabatic transition state theory, Phase space, Planck constant, Potential energy surface, Princeton University, Reaction rate, Reagent, René Marcelin, Richard C. Tolman, Saddle point, Statistical mechanics, Svante Arrhenius, Thermodynamic temperature, Transition state, University of Manchester, University of North Carolina at Chapel Hill, Van 't Hoff equation, Variational transition-state theory, William Lewis (chemist).

Arrhenius equation

The Arrhenius equation is a formula for the temperature dependence of reaction rates.

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Boltzmann constant

The Boltzmann constant, which is named after Ludwig Boltzmann, is a physical constant relating the average kinetic energy of particles in a gas with the temperature of the gas.

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Chemical equilibrium

In a chemical reaction, chemical equilibrium is the state in which both reactants and products are present in concentrations which have no further tendency to change with time, so that there is no observable change in the properties of the system.

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Chemical reaction

A chemical reaction is a process that leads to the transformation of one set of chemical substances to another.

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Collision theory

Collision theory is a theory proposed independently by Max Trautz in 1916 and William Lewis in 1918, that qualitatively explains how chemical reactions occur and why reaction rates differ for different reactions.

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Curtin–Hammett principle

The Curtin–Hammett principle is a principle in chemical kinetics proposed by David Yarrow Curtin and Louis Plack Hammett.

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Dennis A. Dougherty

Dennis A. Dougherty (born December 4, 1952 in Harrisburg, Pennsylvania) is the George Grant Hoag Professor of Chemistry at California Institute of Technology.

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Enthalpy

Enthalpy is a property of a thermodynamic system.

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Entropy of activation

In chemical kinetics, the entropy of activation of a reaction is one of the two parameters (along with the enthalpy of activation) which are typically obtained from the temperature dependence of a reaction rate constant, when these data are analyzed using the Eyring equation.

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Enzyme catalysis

Enzyme catalysis is the increase in the rate of a chemical reaction by the active site of a protein.

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Equilibrium constant

The equilibrium constant of a chemical reaction is the value of its reaction quotient at chemical equilibrium, a state approached by a dynamic chemical system after sufficient time has elapsed at which its composition has no measurable tendency towards further change.

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Eugene Wigner

Eugene Paul "E.

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Eyring equation

The Eyring equation (occasionally also known as Eyring–Polanyi equation) is an equation used in chemical kinetics to describe the variance of the rate of a chemical reaction with temperature.

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Gas constant

The gas constant is also known as the molar, universal, or ideal gas constant, denoted by the symbol or and is equivalent to the Boltzmann constant, but expressed in units of energy per temperature increment per mole, i.e. the pressure-volume product, rather than energy per temperature increment per particle.

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Gibbs free energy

In thermodynamics, the Gibbs free energy (IUPAC recommended name: Gibbs energy or Gibbs function; also known as free enthalpy to distinguish it from Helmholtz free energy) is a thermodynamic potential that can be used to calculate the maximum of reversible work that may be performed by a thermodynamic system at a constant temperature and pressure (isothermal, isobaric).

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Henry Eyring (chemist)

Henry Eyring (February 20, 1901 – December 26, 1981) was a Mexican-born American theoretical chemist whose primary contribution was in the study of chemical reaction rates and intermediates.

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Jacobus Henricus van 't Hoff

Jacobus Henricus van 't Hoff, Jr. (30 August 1852 – 1 March 1911) was a Dutch physical chemist.

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James Clerk Maxwell

James Clerk Maxwell (13 June 1831 – 5 November 1879) was a Scottish scientist in the field of mathematical physics.

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Karl Herzfeld

Karl Ferdinand Herzfeld (February 24, 1892 – June 3, 1978) was an Austrian-American physicist.

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Keith J. Laidler

Keith James Laidler (January 3, 1916 – August 26, 2003), born in England, was notable as a pioneer in chemical kinetics and authority on the physical chemistry of enzymes.

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Kinetic theory of gases

The kinetic theory describes a gas as a large number of submicroscopic particles (atoms or molecules), all of which are in constant rapid motion that has randomness arising from their many collisions with each other and with the walls of the container.

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Leopold Pfaundler

Leopold Pfaundler von Hadermur (14 February 1839 – 6 May 1920) was an Austrian physicist and chemist born in Innsbruck.

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Linus Pauling

Linus Carl Pauling (February 28, 1901 – August 19, 1994) was an American chemist, biochemist, peace activist, author, educator, and husband of American human rights activist Ava Helen Pauling.

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Ludwig Boltzmann

Ludwig Eduard Boltzmann (February 20, 1844 – September 5, 1906) was an Austrian physicist and philosopher whose greatest achievement was in the development of statistical mechanics, which explains and predicts how the properties of atoms (such as mass, charge, and structure) determine the physical properties of matter (such as viscosity, thermal conductivity, and diffusion).

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Max Trautz

Max Trautz (19 March 1880 – 19 August 1960) was a German chemist.

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Maxwell–Boltzmann distribution

In physics (in particular in statistical mechanics), the Maxwell–Boltzmann distribution is a particular probability distribution named after James Clerk Maxwell and Ludwig Boltzmann.

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Meredith Gwynne Evans

Meredith Gwynne Evans, FRS (2 December 1904 – 25 December 1952) was a British physical chemist, who made important theoretical contributions in the study of chemical reaction rates and reaction mechanisms.

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Michael Polanyi

Michael Polanyi, (11 March 1891 – 22 February 1976) was a Hungarian-British polymath, who made important theoretical contributions to physical chemistry, economics, and philosophy.

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Molecular vibration

A molecular vibration occurs when atoms in a molecule are in periodic motion while the molecule as a whole has constant translational and rotational motion.

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Nonadiabatic transition state theory

Nonadiabatic transition state theory (NA-TST) is a powerful tool to predict rates of chemical reactions from a computational standpoint.

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Phase space

In dynamical system theory, a phase space is a space in which all possible states of a system are represented, with each possible state corresponding to one unique point in the phase space.

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Planck constant

The Planck constant (denoted, also called Planck's constant) is a physical constant that is the quantum of action, central in quantum mechanics.

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Potential energy surface

A potential energy surface (PES) describes the energy of a system, especially a collection of atoms, in terms of certain parameters, normally the positions of the atoms.

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Princeton University

Princeton University is a private Ivy League research university in Princeton, New Jersey.

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Reaction rate

The reaction rate or rate of reaction is the speed at which reactants are converted into products.

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Reagent

A reagent is a substance or compound added to a system to cause a chemical reaction, or added to test if a reaction occurs.

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René Marcelin

René Marcelin (12 June 1885-24 September 1914) was a French physical chemist, who died in World War I at a young age.

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Richard C. Tolman

Richard Chace Tolman (March 4, 1881 – September 5, 1948) was an American mathematical physicist and physical chemist who was an authority on statistical mechanics.

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Saddle point

In mathematics, a saddle point or minimax point is a point on the surface of the graph of a function where the slopes (derivatives) of orthogonal function components defining the surface become zero (a stationary point) but are not a local extremum on both axes.

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Statistical mechanics

Statistical mechanics is one of the pillars of modern physics.

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Svante Arrhenius

Svante August Arrhenius (19 February 1859 – 2 October 1927) was a Nobel-Prize winning Swedish scientist, originally a physicist, but often referred to as a chemist, and one of the founders of the science of physical chemistry.

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Thermodynamic temperature

Thermodynamic temperature is the absolute measure of temperature and is one of the principal parameters of thermodynamics.

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Transition state

The transition state of a chemical reaction is a particular configuration along the reaction coordinate.

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University of Manchester

The University of Manchester is a public research university in Manchester, England, formed in 2004 by the merger of the University of Manchester Institute of Science and Technology and the Victoria University of Manchester.

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University of North Carolina at Chapel Hill

The University of North Carolina at Chapel Hill, also known as UNC, UNC Chapel Hill, the University of North Carolina, or simply Carolina, is a public research university located in Chapel Hill, North Carolina, United States.

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Van 't Hoff equation

The van 't Hoff equation relates the change in the equilibrium constant,, of a chemical reaction to the change in temperature, T, given the standard enthalpy change,, for the process.

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Variational transition-state theory

Variational transition-state theory is a refinement of transition-state theory.

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William Lewis (chemist)

William Henry Lewis (1869 – 25 May 1963) was Professor of Chemistry at the University of Exeter for more than 30 years.

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Redirects here:

Absolute reaction rate theory, Activated complex theory, Theory of absolute rate, Transition-State Theory, Transition-state theory.

References

[1] https://en.wikipedia.org/wiki/Transition_state_theory

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