Matches in SemOpenAlex for { <https://semopenalex.org/work/W2575240050> ?p ?o ?g. }
- W2575240050 endingPage "968" @default.
- W2575240050 startingPage "958" @default.
- W2575240050 abstract "The impressive photovoltaic performance of hybrid iodide CH3NH3PbI3 perovskite relies, among other factors, on the optimal alignment of the electronic energy levels of the semiconductor with respect to conventional hole transporting (HTM) and electron transporting (ETM) materials. Here, we first report on density functional theory electronic structure calculations of slab models of the (001) surface aiming to assess how the perovskite valence and conduction band edge (VBE and CBE) energies depend on the nature of the surface exposed to vacuum. We find that the surface termination plays a critical role in determining the energies of the frontier crystal orbitals, with PbI-terminated surface showing VBE and CBE energy ∼1 eV below the corresponding levels in the methylammonium-terminated surfaces. We next build perovskite/C60 interfaces based on two such surfaces and discuss the associated electronic structure in light of recent experimental data. The two interfaces are rather inert showing limited band bend..." @default.
- W2575240050 created "2017-01-26" @default.
- W2575240050 creator A5029460508 @default.
- W2575240050 creator A5049379555 @default.
- W2575240050 creator A5073400216 @default.
- W2575240050 date "2017-01-31" @default.
- W2575240050 modified "2023-10-17" @default.
- W2575240050 title "Influence of Surface Termination on the Energy Level Alignment at the CH<sub>3</sub>NH<sub>3</sub>PbI<sub>3</sub> Perovskite/C60 Interface" @default.
- W2575240050 cites W1543805007 @default.
- W2575240050 cites W1882399973 @default.
- W2575240050 cites W1968153078 @default.
- W2575240050 cites W1970902810 @default.
- W2575240050 cites W1972277834 @default.
- W2575240050 cites W1974682559 @default.
- W2575240050 cites W1979086238 @default.
- W2575240050 cites W1981910115 @default.
- W2575240050 cites W1982945049 @default.
- W2575240050 cites W1983901034 @default.
- W2575240050 cites W1988182882 @default.
- W2575240050 cites W1988320534 @default.
- W2575240050 cites W1990140174 @default.
- W2575240050 cites W1996024106 @default.
- W2575240050 cites W1998343415 @default.
- W2575240050 cites W2004056552 @default.
- W2575240050 cites W2004600977 @default.
- W2575240050 cites W2020043850 @default.
- W2575240050 cites W2032151329 @default.
- W2575240050 cites W2037882760 @default.
- W2575240050 cites W2044591029 @default.
- W2575240050 cites W2044956587 @default.
- W2575240050 cites W2047218923 @default.
- W2575240050 cites W2056269736 @default.
- W2575240050 cites W2057327293 @default.
- W2575240050 cites W2058426729 @default.
- W2575240050 cites W2059159281 @default.
- W2575240050 cites W2061216275 @default.
- W2575240050 cites W2063046797 @default.
- W2575240050 cites W2067066372 @default.
- W2575240050 cites W2069492492 @default.
- W2575240050 cites W2070088220 @default.
- W2575240050 cites W2073726416 @default.
- W2575240050 cites W2075511306 @default.
- W2575240050 cites W2078019609 @default.
- W2575240050 cites W2078616015 @default.
- W2575240050 cites W2081398627 @default.
- W2575240050 cites W2081640113 @default.
- W2575240050 cites W2081909864 @default.
- W2575240050 cites W2082052057 @default.
- W2575240050 cites W2083689629 @default.
- W2575240050 cites W2086776294 @default.
- W2575240050 cites W2087585288 @default.
- W2575240050 cites W2091135029 @default.
- W2575240050 cites W2091960457 @default.
- W2575240050 cites W2093495623 @default.
- W2575240050 cites W2093689405 @default.
- W2575240050 cites W2105759630 @default.
- W2575240050 cites W2114118829 @default.
- W2575240050 cites W2116027828 @default.
- W2575240050 cites W2116726557 @default.
- W2575240050 cites W2120145199 @default.
- W2575240050 cites W2144574847 @default.
- W2575240050 cites W2150687058 @default.
- W2575240050 cites W2160785667 @default.
- W2575240050 cites W2216441014 @default.
- W2575240050 cites W2239555525 @default.
- W2575240050 cites W2318483779 @default.
- W2575240050 cites W2332088835 @default.
- W2575240050 cites W2333594780 @default.
- W2575240050 cites W2335117866 @default.
- W2575240050 cites W2340034139 @default.
- W2575240050 cites W2343871917 @default.
- W2575240050 cites W2415387139 @default.
- W2575240050 cites W2432489276 @default.
- W2575240050 cites W2513818173 @default.
- W2575240050 cites W2514252498 @default.
- W2575240050 cites W3021631286 @default.
- W2575240050 cites W3102471919 @default.
- W2575240050 cites W3105103439 @default.
- W2575240050 doi "https://doi.org/10.1021/acs.chemmater.6b03259" @default.
- W2575240050 hasPublicationYear "2017" @default.
- W2575240050 type Work @default.
- W2575240050 sameAs 2575240050 @default.
- W2575240050 citedByCount "143" @default.
- W2575240050 countsByYear W25752400502017 @default.
- W2575240050 countsByYear W25752400502018 @default.
- W2575240050 countsByYear W25752400502019 @default.
- W2575240050 countsByYear W25752400502020 @default.
- W2575240050 countsByYear W25752400502021 @default.
- W2575240050 countsByYear W25752400502022 @default.
- W2575240050 countsByYear W25752400502023 @default.
- W2575240050 crossrefType "journal-article" @default.
- W2575240050 hasAuthorship W2575240050A5029460508 @default.
- W2575240050 hasAuthorship W2575240050A5049379555 @default.
- W2575240050 hasAuthorship W2575240050A5073400216 @default.
- W2575240050 hasConcept C113843644 @default.
- W2575240050 hasConcept C121332964 @default.
- W2575240050 hasConcept C155011858 @default.
- W2575240050 hasConcept C159467904 @default.