Journal
CHEMICAL COMMUNICATIONS
Volume 51, Issue 43, Pages 8935-8938Publisher
ROYAL SOC CHEMISTRY
DOI: 10.1039/c5cc02129d
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Funding
- EPSRC Grant [EP/L000202, EP/K016288/1, EP/J017361/1]
- Royal Society
- ERC [277757]
- EPSRC [EP/J017361/1, EP/K016288/1, EP/L000202/1] Funding Source: UKRI
- Engineering and Physical Sciences Research Council [EP/K016288/1, EP/J017361/1, EP/L000202/1] Funding Source: researchfish
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We predict the ionisation potentials of the hole-conducting material SPIRO-OMeTAD and twelve methoxy isomers and polymethoxy derivatives. Based on electronic and economic factors, we identify the optimal compounds for application as p-type hole-selective contacts in hybrid halide perovskite solar cells.
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