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Published on: May 27, 2020
Mori-Zwanzig projection operator formalism for far-from-equilibrium systems with time-dependent Hamiltonians
Michael Te Vrugt1,2, Raphael Wittkowski1,2,3
1Institut für Theoretische Physik, Westfälische Wilhelms-Universität Münster, 48149 Münster, Germany.
This study generalizes the Mori-Zwanzig formalism to handle time-dependent Hamiltonians, enabling new applications in physics and chemistry. The enhanced method provides accurate spin relaxation theories for complex systems.
Area of Science:
- Statistical Mechanics
- Theoretical Physics
Background:
- The Mori-Zwanzig projection operator formalism is crucial for deriving mesoscopic and macroscopic theories from microscopic equations.
- Current limitations prevent its direct application to systems with time-dependent Hamiltonians, which are common in areas like driven soft matter and nuclear magnetic resonance.
Purpose of the Study:
- To generalize the Mori-Zwanzig formalism to accommodate time-dependent Hamiltonians.
- To extend the formalism's applicability to classical and quantum systems, near and far from thermodynamic equilibrium, and for time-dependent observables.
Main Methods:
- Derivation of a generalized Mori-Zwanzig formalism for time-dependent systems.
- Development of approximation techniques for equations of motion and correlation functions.
- Application to spin relaxation in a time-dependent external magnetic field.
Main Results:
- A novel Mori-Zwanzig formalism capable of treating time-dependent Hamiltonians has been derived.
- Approximation techniques have been developed to enhance practical usability.
- The Bloch equations for spin relaxation were derived from first principles, including microscopic expressions for relaxation times.
Conclusions:
- The generalized Mori-Zwanzig formalism successfully extends the theory to systems with time-dependent Hamiltonians.
- The developed approximations and demonstrated application to spin relaxation highlight the formalism's practical utility.
- This work opens new avenues for theoretical modeling in diverse fields of physics and chemistry.
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