{ "id": "2103.10087", "version": "v1", "published": "2021-03-18T08:45:26.000Z", "updated": "2021-03-18T08:45:26.000Z", "title": "Anharmonic phonon-phonon scattering at interface by non-equilibrium Green's function formalism", "authors": [ "Yangyu Guo", "Zhongwei Zhang", "Marc Bescond", "Shiyun Xiong", "Masahiro Nomura", "Sebastian Volz" ], "categories": [ "cond-mat.mes-hall" ], "abstract": "The understanding and modeling of inelastic scattering of thermal phonons at a solid/solid interface remain an open question. We present a fully quantum theoretical scheme to quantify the effect of anharmonic phonon-phonon scattering at an interface via non-equilibrium Green's function (NEGF) formalism. Based on the real-space scattering rate matrix, a decomposition of the interfacial spectral energy exchange is made into contributions from local and non-local anharmonic interactions, of which the former is shown to be predominant for high-frequency phonons whereas both are important for low-frequency phonons. The anharmonic decay of interfacial phonon modes is revealed to play a crucial role in bridging the bulk modes across the interface. The overall quantitative contribution of anharmonicity to thermal boundary conductance is found to be moderate. The present work promotes a deeper understanding of heat transport at the interface and an intuitive interpretation of anharmonic phonon NEGF formalism.", "revisions": [ { "version": "v1", "updated": "2021-03-18T08:45:26.000Z" } ], "analyses": { "keywords": [ "non-equilibrium greens function formalism", "anharmonic phonon-phonon scattering", "anharmonic phonon negf formalism", "interfacial spectral energy exchange", "thermal boundary conductance" ], "note": { "typesetting": "TeX", "pages": 0, "language": "en", "license": "arXiv", "status": "editable" } } }