Sensitivity to the initial conditions of the Time-Dependent Density Functional Theory

• URL: http://arxiv.org/abs/2108.10858v2
• Date: Tue, 5 Apr 2022 00:24:13 GMT
• Title: Sensitivity to the initial conditions of the Time-Dependent Density Functional Theory
• Authors: Aurel Bulgac and Ibrahim Abdurrahman and Gabriel Wlaz{\l}owski
• Abstract summary: Time-Dependent Density Functional Theory is mathematically formulated through non-linear coupled time-dependent 3-dimensional partial differential equations. Our analysis, for a number of quantum superfluid many-body systems with a classical equivalent number of degrees of freedom, suggests that its maximum Lyapunov exponents are negligible for all practical purposes.
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• License: http://arxiv.org/licenses/nonexclusive-distrib/1.0/
• Abstract: Time-Dependent Density Functional Theory is mathematically formulated through non-linear coupled time-dependent 3-dimensional partial differential equations and it is natural to expect a strong sensitivity of its solutions to variations of the initial conditions, akin to the butterfly effect ubiquitous in classical dynamics. Since the Schr\"odinger equation for an interacting many-body system is however linear and mathematically the exact equations of the Density Functional Theory reproduce the corresponding one-body properties, it would follow that the Lyapunov exponents are also vanishing within a Density Functional Theory framework. Whether for realistic implementations of the Time-Dependent Density Functional Theory the question of absence of the butterfly effect and whether the dynamics provided is indeed a predictable theory was never discussed. At the same time, since the time-dependent density functional theory is a unique tool allowing us the study of non-equilibrium dynamics of strongly interacting many-fermion systems, the question of predictability of this theoretical framework is of paramount importance. Our analysis, for a number of quantum superfluid many-body systems (unitary Fermi gas, nuclear fission, and heavy-ion collisions) with a classical equivalent number of degrees of freedom ${\cal O}(10^{10})$ and larger, suggests that its maximum Lyapunov exponents are negligible for all practical purposes.

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