Matches in SemOpenAlex for { <https://semopenalex.org/work/W3215532580> ?p ?o ?g. }
- W3215532580 abstract "Abstract Despite governing heat management in any realistic device, the microscopic mechanisms of heat transport in all-solid-state electrolytes are poorly known: existing calculations, all based on simplistic semi-empirical models, are unreliable for superionic conductors and largely overestimate their thermal conductivity. In this work, we deploy a combination of state-of-the-art methods to calculate the thermal conductivity of a prototypical Li-ion conductor, the Li 3 ClO antiperovskite. By leveraging ab initio, machine learning, and force-field descriptions of interatomic forces, we are able to reveal the massive role of anharmonic interactions and diffusive defects on the thermal conductivity and its temperature dependence, and to eventually embed their effects into a simple rationale which is likely applicable to a wide class of ionic conductors." @default.
- W3215532580 created "2021-12-06" @default.
- W3215532580 creator A5016865358 @default.
- W3215532580 creator A5031150435 @default.
- W3215532580 creator A5063297131 @default.
- W3215532580 date "2022-01-28" @default.
- W3215532580 modified "2023-10-17" @default.
- W3215532580 title "Temperature- and vacancy-concentration-dependence of heat transport in Li3ClO from multi-method numerical simulations" @default.
- W3215532580 cites W1550186202 @default.
- W3215532580 cites W1668732012 @default.
- W3215532580 cites W1695703141 @default.
- W3215532580 cites W1698065375 @default.
- W3215532580 cites W1926252740 @default.
- W3215532580 cites W1967902466 @default.
- W3215532580 cites W1972481136 @default.
- W3215532580 cites W1972767018 @default.
- W3215532580 cites W1981368803 @default.
- W3215532580 cites W1984359813 @default.
- W3215532580 cites W1996879303 @default.
- W3215532580 cites W2001676859 @default.
- W3215532580 cites W2004187513 @default.
- W3215532580 cites W2014038743 @default.
- W3215532580 cites W2017347525 @default.
- W3215532580 cites W2018657387 @default.
- W3215532580 cites W2018763953 @default.
- W3215532580 cites W2019465613 @default.
- W3215532580 cites W2026684952 @default.
- W3215532580 cites W2029010401 @default.
- W3215532580 cites W2033666799 @default.
- W3215532580 cites W2034677177 @default.
- W3215532580 cites W2036113194 @default.
- W3215532580 cites W2046001409 @default.
- W3215532580 cites W2051409737 @default.
- W3215532580 cites W2051447808 @default.
- W3215532580 cites W2056795186 @default.
- W3215532580 cites W2057477511 @default.
- W3215532580 cites W2061185866 @default.
- W3215532580 cites W2070514626 @default.
- W3215532580 cites W2073531811 @default.
- W3215532580 cites W2079153216 @default.
- W3215532580 cites W2085093563 @default.
- W3215532580 cites W2088203447 @default.
- W3215532580 cites W2088925839 @default.
- W3215532580 cites W2088947837 @default.
- W3215532580 cites W2120145199 @default.
- W3215532580 cites W2157190342 @default.
- W3215532580 cites W2183964799 @default.
- W3215532580 cites W2192189580 @default.
- W3215532580 cites W2232134042 @default.
- W3215532580 cites W2297618351 @default.
- W3215532580 cites W2312522041 @default.
- W3215532580 cites W2317112787 @default.
- W3215532580 cites W2323443048 @default.
- W3215532580 cites W2324167872 @default.
- W3215532580 cites W2466777838 @default.
- W3215532580 cites W2469485004 @default.
- W3215532580 cites W2606707617 @default.
- W3215532580 cites W2618037459 @default.
- W3215532580 cites W2765499981 @default.
- W3215532580 cites W2765578800 @default.
- W3215532580 cites W2775145325 @default.
- W3215532580 cites W2775708988 @default.
- W3215532580 cites W2885102986 @default.
- W3215532580 cites W2899113375 @default.
- W3215532580 cites W2906840869 @default.
- W3215532580 cites W2926633085 @default.
- W3215532580 cites W2963150135 @default.
- W3215532580 cites W3002358157 @default.
- W3215532580 cites W3006005697 @default.
- W3215532580 cites W3014196593 @default.
- W3215532580 cites W3040990148 @default.
- W3215532580 cites W3083787461 @default.
- W3215532580 cites W3099409622 @default.
- W3215532580 cites W3099527009 @default.
- W3215532580 cites W3100194639 @default.
- W3215532580 cites W3101095095 @default.
- W3215532580 cites W3101438994 @default.
- W3215532580 cites W3101568640 @default.
- W3215532580 cites W3102157866 @default.
- W3215532580 cites W3102912728 @default.
- W3215532580 cites W3155279426 @default.
- W3215532580 cites W3155612668 @default.
- W3215532580 cites W3193012351 @default.
- W3215532580 cites W3195149380 @default.
- W3215532580 cites W3201073812 @default.
- W3215532580 cites W3204099015 @default.
- W3215532580 cites W3204647820 @default.
- W3215532580 cites W3210463757 @default.
- W3215532580 cites W4248181009 @default.
- W3215532580 cites W4254624278 @default.
- W3215532580 cites W4288045464 @default.
- W3215532580 cites W832976576 @default.
- W3215532580 cites W971766965 @default.
- W3215532580 doi "https://doi.org/10.1038/s41524-021-00693-4" @default.
- W3215532580 hasPublicationYear "2022" @default.
- W3215532580 type Work @default.
- W3215532580 sameAs 3215532580 @default.
- W3215532580 citedByCount "11" @default.
- W3215532580 countsByYear W32155325802022 @default.
- W3215532580 countsByYear W32155325802023 @default.