FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2000175013> ?p ?o ?g. }

• W2000175013 abstract "Phonon and electron transport in ${mathrm{Bi}}_{2}{mathrm{Te}}_{3}$ has been investigated using a multiscale approach, combining the first-principles calculations, molecular dynamics (MD) simulations, and Boltzmann transport equations (BTEs). Good agreements are found with the available experimental results. The MD simulations along with the Green-Kubo autocorrelation decay method are used to calculate the lattice thermal conductivity in both the in-plane and cross-plane directions, where the required classical interatomic potentials for ${mathrm{Bi}}_{2}{mathrm{Te}}_{3}$ are developed on the basis of first-principles calculations and experimental results. In the decomposition of the lattice thermal conductivity, the contributions from the short-range acoustic and optical phonons are found to be temperature independent and direction independent, while the long-range acoustic phonons dominate the phonon transport with a strong temperature and direction dependence (represented by a modified Slack relation). The sum of the short-range acoustic and optical phonon contribution is about $0.2phantom{rule{0.3em}{0ex}}mathrm{W}∕mathrm{m}phantom{rule{0.2em}{0ex}}mathrm{K}$ and signifies the limit when the long-range transport is suppressed by nanostructure engineering. The electrical transport is calculated using the full-band structure from the linearized augmented plane-wave method, BTE, and the energy-dependent relaxation-time models with the nonparabolic Kane energy dispersion. Temperature dependence of the energy gap is found to be important for the prediction of electrical transport in the intrinsic regime. Appropriate modeling of relaxation times is also essential for the calculation of electric and thermal transport, especially in the intrinsic regime. The maximum of the Seebeck coefficient appears when the chemical potential approaches the band edge and can be estimated by a simple expression containing the band gap. The scatterings by the acoustic, optical, and polar-optical phonons dominate the electrical conductivity and electric thermal conductivity." @default.
• W2000175013 created "2016-06-24" @default.
• W2000175013 creator A5062242845 @default.
• W2000175013 creator A5066083792 @default.
• W2000175013 date "2008-03-12" @default.
• W2000175013 modified "2023-10-17" @default.
• W2000175013 title "<i>Ab initio</i>and molecular dynamics predictions for electron and phonon transport in bismuth telluride" @default.
• W2000175013 cites W1152935271 @default.
• W2000175013 cites W116239404 @default.
• W2000175013 cites W1494001600 @default.
• W2000175013 cites W1745854265 @default.
• W2000175013 cites W1971018876 @default.
• W2000175013 cites W1976843170 @default.
• W2000175013 cites W1978823781 @default.
• W2000175013 cites W1981368803 @default.
• W2000175013 cites W1981464925 @default.
• W2000175013 cites W1984509009 @default.
• W2000175013 cites W1986306976 @default.
• W2000175013 cites W2000021383 @default.
• W2000175013 cites W2000287325 @default.
• W2000175013 cites W2003268950 @default.
• W2000175013 cites W2006096763 @default.
• W2000175013 cites W2008138468 @default.
• W2000175013 cites W2023016394 @default.
• W2000175013 cites W2023223550 @default.
• W2000175013 cites W2024085431 @default.
• W2000175013 cites W2027698304 @default.
• W2000175013 cites W2029741576 @default.
• W2000175013 cites W2033024300 @default.
• W2000175013 cites W2035245188 @default.
• W2000175013 cites W2036062273 @default.
• W2000175013 cites W2040534691 @default.
• W2000175013 cites W2044316970 @default.
• W2000175013 cites W2056081735 @default.
• W2000175013 cites W2057502998 @default.
• W2000175013 cites W2059425339 @default.
• W2000175013 cites W2062010685 @default.
• W2000175013 cites W2068534852 @default.
• W2000175013 cites W2075937489 @default.
• W2000175013 cites W2078074302 @default.
• W2000175013 cites W2080052089 @default.
• W2000175013 cites W2081870935 @default.
• W2000175013 cites W2145937120 @default.
• W2000175013 cites W2159351871 @default.
• W2000175013 cites W2166117776 @default.
• W2000175013 cites W2334309879 @default.
• W2000175013 cites W2798977091 @default.
• W2000175013 cites W36213798 @default.
• W2000175013 cites W4245099567 @default.
• W2000175013 cites W4299979599 @default.
• W2000175013 cites W971766965 @default.
• W2000175013 cites W2550800700 @default.
• W2000175013 doi "https://doi.org/10.1103/physrevb.77.125209" @default.
• W2000175013 hasPublicationYear "2008" @default.
• W2000175013 type Work @default.
• W2000175013 sameAs 2000175013 @default.
• W2000175013 citedByCount "339" @default.
• W2000175013 countsByYear W20001750132012 @default.
• W2000175013 countsByYear W20001750132013 @default.
• W2000175013 countsByYear W20001750132014 @default.
• W2000175013 countsByYear W20001750132015 @default.
• W2000175013 countsByYear W20001750132016 @default.
• W2000175013 countsByYear W20001750132017 @default.
• W2000175013 countsByYear W20001750132018 @default.
• W2000175013 countsByYear W20001750132019 @default.
• W2000175013 countsByYear W20001750132020 @default.
• W2000175013 countsByYear W20001750132021 @default.
• W2000175013 countsByYear W20001750132022 @default.
• W2000175013 countsByYear W20001750132023 @default.
• W2000175013 crossrefType "journal-article" @default.
• W2000175013 hasAuthorship W2000175013A5062242845 @default.
• W2000175013 hasAuthorship W2000175013A5066083792 @default.
• W2000175013 hasBestOaLocation W20001750132 @default.
• W2000175013 hasConcept C121332964 @default.
• W2000175013 hasConcept C145912823 @default.
• W2000175013 hasConcept C147120987 @default.
• W2000175013 hasConcept C183971685 @default.
• W2000175013 hasConcept C191897082 @default.
• W2000175013 hasConcept C192562407 @default.
• W2000175013 hasConcept C207365445 @default.
• W2000175013 hasConcept C24169881 @default.
• W2000175013 hasConcept C24890656 @default.
• W2000175013 hasConcept C26873012 @default.
• W2000175013 hasConcept C2777038907 @default.
• W2000175013 hasConcept C2781442258 @default.
• W2000175013 hasConcept C32909587 @default.
• W2000175013 hasConcept C533668322 @default.
• W2000175013 hasConcept C59593255 @default.
• W2000175013 hasConcept C62520636 @default.
• W2000175013 hasConcept C63024428 @default.
• W2000175013 hasConceptScore W2000175013C121332964 @default.
• W2000175013 hasConceptScore W2000175013C145912823 @default.
• W2000175013 hasConceptScore W2000175013C147120987 @default.
• W2000175013 hasConceptScore W2000175013C183971685 @default.
• W2000175013 hasConceptScore W2000175013C191897082 @default.
• W2000175013 hasConceptScore W2000175013C192562407 @default.
• W2000175013 hasConceptScore W2000175013C207365445 @default.
• W2000175013 hasConceptScore W2000175013C24169881 @default.
• W2000175013 hasConceptScore W2000175013C24890656 @default.
• W2000175013 hasConceptScore W2000175013C26873012 @default.

• next