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dc.contributor.authorHsieh, Chang Yu
dc.contributor.authorCao, Jianshu
dc.date.accessioned2020-07-07T13:12:39Z
dc.date.available2020-07-07T13:12:39Z
dc.date.issued2019-06
dc.identifier.issn1932-7447
dc.identifier.urihttps://hdl.handle.net/1721.1/126058
dc.description.abstractWe propose a nonequilibrium variational polaron transformation, based on an ansatz for nonequilibrium steady state with an effective temperature, to study quantum heat transport at the nanoscale. By combining the variational polaron transformed master equation with the full counting statistics, we extended the applicability of the polaron-based framework to study nonequilibrium process beyond the super-Ohmic bath models. Previously, the polaron-based framework for quantum heat transport reduces exactly to the non-interacting blip approximation (NIBA) formalism for Ohmic bath models due to the issue of the infrared divergence associated with the full polaron transformation. The nonequilibrium variational method allows us to appropriately treat the infrared divergence in the low-frequency bath modes and explicitly include cross-bath correlation effects. These improvements provide more accurate calculation of heat current than the NIBA formalism for Ohmic bath models. We illustrate the aforementioned improvements with the nonequilibrium spin-boson model in this work and quantitatively demonstrate the cross-bath correlation, current turnover, and rectification effects in quantum heat transfer.en_US
dc.description.sponsorshipNational Science Foundation (U.S.) (Grant CHE 1836913)en_US
dc.description.sponsorshipNational Science Foundation (U.S.) (Grant CHE 1800301)en_US
dc.language.isoen
dc.publisherAmerican Chemical Society (ACS)en_US
dc.relation.isversionof10.1021/ACS.JPCC.9B05607en_US
dc.rightsArticle is made available in accordance with the publisher's policy and may be subject to US copyright law. Please refer to the publisher's site for terms of use.en_US
dc.sourceOther repositoryen_US
dc.titleA Nonequilibrium Variational Polaron Theory to Study Quantum Heat Transporten_US
dc.typeArticleen_US
dc.identifier.citationHsieh, Chang Yu et al. “A Nonequilibrium Variational Polaron Theory to Study Quantum Heat Transport.” Journal of physical chemistry. C, vol. 123, no. 28, 2019, pp. 17196-17204 © 2019 The Author(s)en_US
dc.contributor.departmentMassachusetts Institute of Technology. Department of Chemistryen_US
dc.relation.journalJournal of physical chemistry. Cen_US
dc.eprint.versionAuthor's final manuscripten_US
dc.type.urihttp://purl.org/eprint/type/JournalArticleen_US
eprint.statushttp://purl.org/eprint/status/PeerRevieweden_US
dc.date.updated2019-12-13T18:39:26Z
dspace.date.submission2019-12-13T18:39:31Z
mit.journal.volume123en_US
mit.journal.issue28en_US
mit.licensePUBLISHER_POLICY
mit.metadata.statusComplete


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