The DOI matches its Crossref record; 31 of the 31 references it cites were found in a registry or an index.
Polarons, Bipolarons, And Absorption Spectroscopy of PEDOT
Abstract
Electronic structure and optical absorption spectra of poly(3,4-ethylenedioxythiophene) (PEDOT) for different oxidation levels were studied using density functional theory (DFT) and time-dependent DFT. It is shown, that the DFT-based predictions for the polaronic and bipolaronic states and the nature of corresponding optical transitions are qualitatively different from the widely used traditional picture based on semi-empirical pre-DFT approaches that still dominate the current literature. On the basis of the results of our calculations, the experimental Vis/NIR absorbance spectroscopy and the electron paramagnetic resonance spectroscopy are re-examined, and a new interpretation of the measured spectra and the spin signal, which is qualitatively different from the traditional interpretation, is provided. The findings and conclusions concerning the nature of polaronic and bipolaronic states, band structure and absorption spectra presented for PEDOT, are generic for a wide class of conducting polymers (such as polythiophenes and their derivatives) that have a similar structure of monomer units.
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Cites
Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction
Grimme, S. (2006) · Journal of Computational Chemistry · doi:10.1002/jcc.20495 · Cited by 31,038
Long-range corrected hybrid density functionals with damped atom–atom dispersion corrections
Chai, J.-D., & Head-Gordon, M. (2008) · Physical Chemistry Chemical Physics · doi:10.1039/b810189b · Cited by 14,648
Handbook of conducting polymers
Skotheim, T. A., Elsenbaumer, R. L., & Reynolds, J. R. (1986) · M. Dekker eBooks · Cited by 8,079
Insights into Current Limitations of Density Functional Theory
Cohen, A. J., Mori-Sánchez, P., & Yang, W. (2008) · Science · doi:10.1126/science.1158722 · Cited by 2,527
Organic electrochemical transistors
Rivnay, J., Inal, S., Salleo, A., Owens, R. M., Berggren, M., & Malliaras, G. G. (2018) · Nature Reviews Materials · doi:10.1038/natrevmats.2017.86 · Cited by 2,065
Self-citationBubnova, O., Khan, Z. U., Malti, A., Braun, S., Fahlman, M., Berggren, M., & Crispin, X. (2011) · Nature Materials · doi:10.1038/nmat3012 · Cited by 1,769
Self-citationPerspective on density functional theory
Burke, K. (2012) · The Journal of Chemical Physics · doi:10.1063/1.4704546 · Cited by 1,676
Electronic structure of quantum dots
Reimann, S. M., & Manninen, M. (2002) · Reviews of Modern Physics · doi:10.1103/revmodphys.74.1283 · Cited by 1,380
Bredas, J.-L. (2014) · Mater. Horiz. · doi:10.1039/c3mh00098b · Cited by 1,140
Bubnova, O., Khan, Z. U., Wang, H., Braun, S., Evans, D. R., Fabretto, M., Hojati-Talemi, P., Dagnelund, D., Arlin, J.-B., Geerts, Y. H., et al. (2014) · Nature Materials · doi:10.1038/nmat3824 · Cited by 854
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Cea, C., Spyropoulos, G. D., Jastrzebska-Perfect, P., Ferrero, J. J., Gelinas, J. N., & Khodagholy, D. (2020) · Nature Materials · doi:10.1038/s41563-020-0638-3 · Cited by 292
3D Printable Conducting and Biocompatible PEDOT‐graft‐PLA Copolymers by Direct Ink Writing
Dominguez‐Alfaro, A., Gabirondo, E., Alegret, N., De León‐Almazán, C. M., Hernandez, R., Vallejo‐Illarramendi, A., Prato, M., & Mecerreyes, D. (2021) · Macromolecular Rapid Communications · doi:10.1002/marc.202100100 · Cited by 44
Metadata
- Authors
- Zozoulenko, I., Singh, A., Singh, S. K., Gueskine, V., Crispin, X., & Berggren, M.
- Venue
- ACS Applied Polymer Materials
- Publisher
- American Chemical Society (ACS)
- Published
- 2018-12-11
- Volume
- 1
- Issue
- 1
- Pages
- 83-94
- ISSN
- 2637-6105 (ISSN-L)
- OpenAlex
- W2903669415
- Cited by
- 373
- References
- 31
- FWCI
- 13.50
- Type
- journal article
- Language
- en
- Open access
- closed
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- Zozoulenko, I., Singh, A., Singh, S. K., Gueskine, V., Crispin, X., & Berggren, M. (2019). Polarons, Bipolarons, And Absorption Spectroscopy of PEDOT. ACS Applied Polymer Materials. https://doi.org/10.1021/acsapm.8b00061
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