This work explores intuitive constructions for optimization algorithms based on quantum system dynamics and kinetic energy concepts, examining the physical mechanisms and potential risks in the optimization process, and exploring predictive factors for performance in complex systems.
One of the major application areas of interest for both near-term and fault-tolerant quantum computers is the optimization of classical objective functions. In this work, we develop intuitive constructions for a large class of these algorithms based on connections to simple dynamics of quantum systems, quantum walks, and classical continuous relaxations. We focus on developing a language and tools connected with kinetic energy on a graph for understanding the physical mechanisms of success and failure to guide algorithmic improvement. This physical language, in combination with uniqueness results related to unitarity, allow us to identify some potential pitfalls from kinetic energy fundamentally opposing the goal of optimization. This is connected to effects from wavefunction confinement, phase randomization, and shadow defects lurking in the objective far away from the ideal solution. As an example, we explore the surprising deficiency of many quantum methods in solving uncoupled spin problems and how this is both predictive of performance on some more complex systems while immediately suggesting simple resolutions. Further examination of canonical problems like the Hamming ramp or bush of implications show that entanglement can be strictly detrimental to performance results from the underlying mechanism of solution in approaches like the quantum approximate optimization algorithm (QAOA). Kinetic energy and graph Laplacian perspectives provide new insights to common initialization and optimal solutions in QAOA as well as new methods for more effective layerwise training. Connections to classical methods of continuous extensions, homotopy methods, and iterated rounding suggest new directions for research in quantum optimization. Throughout, we unveil many pitfalls and mechanisms in quantum optimization using a physical perspective, which aim to spur the development of novel quantum optimization algorithms and refinements.
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