Influence of backbone modification of difluoroquinoxaline-based copolymers on the interchain packing, blend morphology and photovoltaic properties of nonfullerene organic solar cells

Yuxiang Li, Minseok Kim, Ziang Wu, Changyeon Lee, Young Woong Lee, Jin Woo Lee, Young Jun Lee, Ergang Wang, Bumjoon J. Kim, Han Young Woo

Research output: Contribution to journalArticle

3 Citations (Scopus)

Abstract

In order to understand the influence of molecular ordering and orientation on the performance of nonfullerene (NF) solar cells, we synthesized a series of difluoroquinoxaline-based alternating copolymers: starting from poly(2,2′-bithiophene-alt-(2,3-bis(3,4-bis(octyloxy)phenyl)-6,7-difluoroquinoxaline)) (PDFQx-2T), we modified the polymeric backbone by incorporating fluorine atoms (PDFQx-2T2F) or thiophene (PDFQx-3T) or a benzene ring (PDFQx-2TB) in the bithiophene comonomeric unit. The structure modification significantly affected the photovoltaic performance with power conversion efficiencies (PCEs) of 3.95% for PDFQx-2TB:ITIC, 4.82% for PDFQx-2T:ITIC, 4.93% for PDFQx-2T2F:ITIC and 8.13% for PDFQx-3T:ITIC. The dramatic increase in the PCE of PDFQx-3T:ITIC was attributed to improvements in the short-circuit current density (J SC ) and fill factor (FF). From the resonant soft X-ray scattering and grazing incidence X-ray scattering measurements, the PDFQx-3T polymers had well-developed, face-on oriented crystallites, allowing the formation of face-to-face alignment with the face-on ordered ITIC molecules at the interfaces. Also, the PDFQx-3T:ITIC blend films exhibited well intermixed blend morphology with smaller domain spacings. These combined features contributed to efficient charge generation with the highest exciton dissociation probability among the four different polymer:ITIC systems. In addition, dominant face-on orientation of both PDFQx-3T polymers and ITIC acceptors with a balanced crystalline coherence length ratio (CCL polymer /CCL ITIC ) (0.87, based on the out-of-plane (010) diffraction peaks of PDFQx polymers and ITIC acceptors) led to a more balanced charge mobility than other blends, explaining the highest J SC and FF in the PDFQx-3T:ITIC NF devices.

Original languageEnglish
Pages (from-to)1681-1689
Number of pages9
JournalJournal of Materials Chemistry C
Volume7
Issue number6
DOIs
Publication statusPublished - 2019 Jan 1

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Polymers
Copolymers
X ray scattering
Conversion efficiency
Thiophenes
Fluorine
Thiophene
Benzene
Crystallites
Excitons
Short circuit currents
Solar cells
Current density
Diffraction
Organic solar cells
Crystalline materials
Atoms
Molecules

ASJC Scopus subject areas

  • Chemistry(all)
  • Materials Chemistry

Cite this

Influence of backbone modification of difluoroquinoxaline-based copolymers on the interchain packing, blend morphology and photovoltaic properties of nonfullerene organic solar cells. / Li, Yuxiang; Kim, Minseok; Wu, Ziang; Lee, Changyeon; Lee, Young Woong; Lee, Jin Woo; Lee, Young Jun; Wang, Ergang; Kim, Bumjoon J.; Woo, Han Young.

In: Journal of Materials Chemistry C, Vol. 7, No. 6, 01.01.2019, p. 1681-1689.

Research output: Contribution to journalArticle

Li, Yuxiang ; Kim, Minseok ; Wu, Ziang ; Lee, Changyeon ; Lee, Young Woong ; Lee, Jin Woo ; Lee, Young Jun ; Wang, Ergang ; Kim, Bumjoon J. ; Woo, Han Young. / Influence of backbone modification of difluoroquinoxaline-based copolymers on the interchain packing, blend morphology and photovoltaic properties of nonfullerene organic solar cells. In: Journal of Materials Chemistry C. 2019 ; Vol. 7, No. 6. pp. 1681-1689.
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abstract = "In order to understand the influence of molecular ordering and orientation on the performance of nonfullerene (NF) solar cells, we synthesized a series of difluoroquinoxaline-based alternating copolymers: starting from poly(2,2′-bithiophene-alt-(2,3-bis(3,4-bis(octyloxy)phenyl)-6,7-difluoroquinoxaline)) (PDFQx-2T), we modified the polymeric backbone by incorporating fluorine atoms (PDFQx-2T2F) or thiophene (PDFQx-3T) or a benzene ring (PDFQx-2TB) in the bithiophene comonomeric unit. The structure modification significantly affected the photovoltaic performance with power conversion efficiencies (PCEs) of 3.95{\%} for PDFQx-2TB:ITIC, 4.82{\%} for PDFQx-2T:ITIC, 4.93{\%} for PDFQx-2T2F:ITIC and 8.13{\%} for PDFQx-3T:ITIC. The dramatic increase in the PCE of PDFQx-3T:ITIC was attributed to improvements in the short-circuit current density (J SC ) and fill factor (FF). From the resonant soft X-ray scattering and grazing incidence X-ray scattering measurements, the PDFQx-3T polymers had well-developed, face-on oriented crystallites, allowing the formation of face-to-face alignment with the face-on ordered ITIC molecules at the interfaces. Also, the PDFQx-3T:ITIC blend films exhibited well intermixed blend morphology with smaller domain spacings. These combined features contributed to efficient charge generation with the highest exciton dissociation probability among the four different polymer:ITIC systems. In addition, dominant face-on orientation of both PDFQx-3T polymers and ITIC acceptors with a balanced crystalline coherence length ratio (CCL polymer /CCL ITIC ) (0.87, based on the out-of-plane (010) diffraction peaks of PDFQx polymers and ITIC acceptors) led to a more balanced charge mobility than other blends, explaining the highest J SC and FF in the PDFQx-3T:ITIC NF devices.",
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