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This research resolves long-standing discrepancies in solid-state physics by establishing a consistent framework for evaluating position-dependent operators within the Bloch representation. By introducing specific rules and a "gauge filtration" scheme, the study reconciles conflicting results regarding wave packet rotation and Wannier function circulation while ensuring gauge independence. This methodological advance provides a rigorous foundation for accurately calculating key condensed-matter observables like orbital moments and electric polarization.
Consistent Evaluation of Operators Involving the Position Operator in the Bloch Representation: Application to the Orbital Moment
arXiv:2606.11679v1 Announce Type: cross Abstract: The position operator plays a central role in condensed-matter observables such as velocity, orbital moment, and electric polarization. In solid-state physics, the evaluation of operators incorporating the position operator has not reached a consensus, as observed in the operator-level discrepancy between the local circulation of Wannier functions and the self-rotation of wave packets. Here, to achieve a consistent evaluation of such operators, we propose three rules for evaluating operators involving the position operator in the Bloch representation. The rules are devised to satisfy physical conditions: independence from the choice of unit cell, preservation of Hermitian conjugacy for the product of operators, and recovery of the correct intraband velocity. We further address the gauge dependence of the position operator and introduce a scheme termed gauge filtration, which systematically removes gauge-dependent contributions from the operators containing the position operator. This methodology ensures that the quantities obtained from the operator evaluation correspond to observable physical phenomena. By applying our framework, we reconcile the results concerning the self-rotation of the wave packet and the local circulation of the Wannier function. We expect our proposal to establish a consistent framework for evaluating operators involving the position operator.
Abstract:The position operator plays a central role in condensed-matter observables such as velocity, orbital moment, and electric polarization. In solid-state physics, the evaluation of operators incorporating the position operator has not reached a consensus, as observed in the operator-level discrepancy between the local circulation of Wannier functions and the self-rotation of wave packets. Here, to achieve a consistent evaluation of such operators, we propose three rules for evaluating operators involving the position operator in the Bloch representation. The rules are devised to satisfy physical conditions: independence from the choice of unit cell, preservation of Hermitian conjugacy for the product of operators, and recovery of the correct intraband velocity. We further address the gauge dependence of the position operator and introduce a scheme termed gauge filtration, which systematically removes gauge-dependent contributions from the operators containing the position operator. This methodology ensures that the quantities obtained from the operator evaluation correspond to observable physical phenomena. By applying our framework, we reconcile the results concerning the self-rotation of the wave packet and the local circulation of the Wannier function. We expect our proposal to establish a consistent framework for evaluating operators involving the position operator.
Mesoscale and Nanoscale Physics (cond-mat.mes-hall); Quantum Physics (quant-ph)
arXiv:2606.11679 [cond-mat.mes-hall]
(or arXiv:2606.11679v1 [cond-mat.mes-hall] for this version)
https://doi.org/10.48550/arXiv.2606.11679 Focus to learn more arXiv-issued DOI via DataCite (pending registration)
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