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Adiabatic Processes for an Ideal Gas01:18

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When an ideal gas is compressed adiabatically, that is, without adding heat, work is done on it, and its temperature increases. In an adiabatic expansion, the gas does work, and its temperature drops. Adiabatic compressions actually occur in the cylinders of a car, where the compressions of the gas-air mixture take place so quickly that there is no time for the mixture to exchange heat with its environment. Nevertheless, because work is done on the mixture during the compression, its...
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Maxwell's thermodynamic relations are very useful in solving problems in thermodynamics. Each of Maxwell's relations relates a partial differential between quantities that can be hard to measure experimentally to a partial differential between quantities that can be easily measured. These relations are a set of equations derivable from the symmetry of the second derivatives and the thermodynamic potentials.
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The Quantum-Mechanical Model of an Atom02:45

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Shortly after de Broglie published his ideas that the electron in a hydrogen atom could be better thought of as being a circular standing wave instead of a particle moving in quantized circular orbits, Erwin Schrödinger extended de Broglie’s work by deriving what is now known as the Schrödinger equation. When Schrödinger applied his equation to hydrogen-like atoms, he was able to reproduce Bohr’s expression for the energy and, thus, the Rydberg formula governing hydrogen spectra.
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Space-Time Curvature and the General Theory of Relativity01:17

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In 1905, Albert Einstein published his special theory of relativity. According to this theory, no matter in the universe can attain a speed greater than the speed of light in a vacuum, which thus serves as the speed limit of the universe.
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Kinetic Theory of an Ideal Gas01:12

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A mole is defined as the amount of any substance that contains as many molecules as there are atoms in exactly 12 grams of carbon-12. An Italian scientist Amedeo Avogadro (1776–1856) formed the  hypothesis that equal volumes of gas at equal pressure and temperature contain equal numbers of molecules, independent of the type of gas. Later, the hypothesis was developed to form the SI unit for measuring the amount of any substance.
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Heat Capacities of an Ideal Gas II01:23

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For a system that undergoes a thermodynamic process at a constant volume condition, the heat absorbed is used only to increase the system's internal energy and not for doing any kind of work. While for a system undergoing a thermodynamic process under a constant pressure condition, the amount of heat absorbed is used not only for increasing the internal energy (as a function of temperature) but also for doing some work. The molar heat capacity is the amount of heat required to increase the...
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Related Experiment Video

Updated: Dec 20, 2025

Scalable Quantum Integrated Circuits on Superconducting Two-Dimensional Electron Gas Platform
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A general non-adiabatic quantum instanton approximation.

Joseph E Lawrence1, David E Manolopoulos1

  • 1Department of Chemistry, University of Oxford, Physical and Theoretical Chemistry Laboratory, South Parks Road, Oxford OX1 3QZ, United Kingdom.

The Journal of Chemical Physics
|June 4, 2020
PubMed
Summary
This summary is machine-generated.

We developed a new quantum method to calculate reaction rates for systems with two electronic states. The non-adiabatic quantum instanton (NAQI) approximation accurately models complex chemical reactions.

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Area of Science:

  • Quantum chemistry
  • Chemical kinetics
  • Theoretical chemistry

Background:

  • Calculating reaction rates is crucial for understanding chemical processes.
  • Existing methods have limitations for systems with strong electronic coupling.

Purpose of the Study:

  • To introduce a general quantum instanton approach for calculating reaction rates.
  • To develop the non-adiabatic quantum instanton (NAQI) approximation.

Main Methods:

  • The NAQI approximation utilizes a saddle point approximation for the time integral of a reactive flux autocorrelation function.
  • It employs a generalized definition of the projection operator onto product states.
  • The method is validated against exact rates for one-dimensional scattering problems.

Main Results:

  • The NAQI approximation unifies existing theories, reducing to Wolynes theory in the golden rule limit and a projected quantum instanton method in the adiabatic limit.
  • Demonstrated accuracy for one-dimensional scattering problems.

Conclusions:

  • The NAQI approximation provides a versatile and accurate tool for calculating reaction rates in systems with two electronic states.
  • The approach is applicable to a range of complex chemical reactions.