An A2–π–A1–π–A2-type small molecule donor for high-performance organic solar cells

Qian Zhang, Yanna Sun, Xianjie Chen, Zhijing Lin, Xin Ke, Xiaoyuan Wang, Tian He, Shouchun Yin, Yongsheng Chen and Huayu Qiu

J. Mater. Chem. C, 2019, 7, 5381
DOI: 10.1039/C9TC01251F

Molecular engineering of carbazole–acrylonitrile fluorophores: substituent-dependent optical properties and mechanochromism

Pengfei Chen, Yuanye Yin, Yingyong Ni, Huichao Zhu, Jianyan Huang, Jiaxiang Yang, Jianjun Yang and Lin Kong

CrystEngComm, 2021, 23, 2289
DOI: 10.1039/D1CE00012H

D–A–A′-type asymmetric small molecules based on triphenylamine-diketopyrrolopyrrole/5,6-difluoro-2,1,3-benzothiadiazole backbone for organic photovoltaic materials

Lunxiang Yin, Qingqing Yuan and Yanqin Li

New J. Chem., 2020, 44, 13319
DOI: 10.1039/D0NJ02239J

A′–A–π–D–π–A–A′ extended small-molecule photovoltaic donor based on fluorene-diketopyrrolopyrrole with an end-group fluorination effect

Yang Liu, Lunxiang Yin, Bao Xie, Chang Liu and Yanqin Li

Mater. Adv., 2022, 3, 6496
DOI: 10.1039/D2MA00510G

The first connection of carbonyl-bridged triarylamine and diketopyrrolopyrrole functionalities to generate a three-dimensional, non-fullerene electron acceptor

Ratan W. Jadhav, Rahul V. Hangarge, Mahmood D. Aljabri, Kerba Shivaji More, Jing-Yu Chen, Lathe A. Jones, Richard A. Evans, Jing-Liang Li, Sheshanath V. Bhosale and Akhil Gupta

Mater. Chem. Front., 2020, 4, 2176
DOI: 10.1039/D0QM00041H

The influence of the terminal acceptor and oligomer length on the photovoltaic properties of A–D–A small molecule donors

Fernando G. Guijarro, Prateek Malhotra, Gaurav Gupta, Ruben Caballero, Pilar de la Cruz, Rahul Singhal, Ganesh D. Sharma and Fernando Langa

J. Mater. Chem. C, 2020, 8, 4763
DOI: 10.1039/D0TC00154F

Novel A-π-D-π-A-type BODIPY dyads as small-molecule donors for solution-processed organic solar cells

Bao Xie, Lunxiang Yin, Junmei Fan, Chang Liu and Yanqin Li

J. Mater. Chem. C, 2022, 10, 3248
DOI: 10.1039/D1TC04981J

Ultrafast excited state relaxation dynamics of pyran-based D–π–A systems: solvent polarity controls the triplet state

Pookalavan Karicherry Vineetha, Chinju Govind, Venugopal Karunakaran and Narayanapillai Manoj

Phys. Chem. Chem. Phys., 2024, 26, 5479
DOI: 10.1039/D3CP04338J

Open-circuit-voltage shift of over 0.5 V in organic photovoltaic cells induced by a minor structural difference in alkyl substituents

Mitsuharu Suzuki, Kengo Terai, Cassandre Quinton, Hironobu Hayashi, Naoki Aratani and Hiroko Yamada

Chem. Sci., 2020, 11, 1825
DOI: 10.1039/C9SC04956H

Tailoring the charge transport characteristics in ordered small-molecule organic semiconductors by side-chain engineering and fluorine substitution

Ilya E. Kuznetsov, Denis V. Anokhin, Alexey A. Piryazev, Maxim E. Sideltsev, Azaliia F. Akhkiamova, Artyom V. Novikov, Vladimir G. Kurbatov, Dimitri A. Ivanov and Alexander V. Akkuratov

Phys. Chem. Chem. Phys., 2022, 24, 16041
DOI: 10.1039/D2CP01758J

Efficient design and structural modifications for tuning the photoelectric properties of small-molecule acceptors in organic solar cells

Xiaodong He, Lunxiang Yin and Yanqin Li

New J. Chem., 2019, 43, 6577
DOI: 10.1039/C9NJ00600A

Photophysical, electrochemical properties and flexible organic solar cell application of 7,7-bis(1-cyclopropyl carbonyl piperazino)-8,8 dicyanoquinodimethane

Anwarhussaini Syed, Renuka H, Anuradha Mohitkar, Raghavaiah Pallepogu, Mahadev Sai Karthik Challa, Sanket Goel and Subbalakshmi Jayanty

Mater. Adv., 2022, 3, 3151
DOI: 10.1039/D1MA00778E

Functionalization of spiro[fluorene-9,9′-xanthene] with diketopyrrolopyrrole to generate a promising, three-dimensional non-fullerene acceptor

Amanpreet Kaur Hundal, Salman Ali, Mohammed Jameel, Lathe Jones, Navneet Kaur, Richard A. Evans, Jing-Liang Li, Steven J. Langford and Akhil Gupta

Mater. Chem. Front., 2020, 4, 3209
DOI: 10.1039/D0QM00515K

Theoretical framework for achieving high Voc in non-fused non-fullerene terthiophene-based end-capped modified derivatives for potential applications in organic photovoltaics

Muhammad Waqas, N. M. A. Hadia, Ahmed M. Shawky, Rana Farhat Mahmood, Manel Essid, Zouhaier Aloui, Naifa S. Alatawi, Javed Iqbal and Rasheed Ahmad Khera

RSC Adv., 2023, 13, 7535
DOI: 10.1039/D3RA00038A

Theoretical investigation on the functional group modulation of UV-Vis absorption profiles of triphenylamine derivatives

Kun Gong, Fang Xu, Zhen Zhao, Wei Li, Dongzhi Liu, Xueqin Zhou and Lichang Wang

Phys. Chem. Chem. Phys., 2023, 25, 22002
DOI: 10.1039/D3CP01630G

Improvement of the optoelectronic and photovoltaic properties of a cyanopyrid-2,6-dione-based donor via molecular engineering

Amanpreet Kaur Hundal, Anubha Agarwal, Mohammed Jameel, Jing-Yu Chen, Jing-Liang Li, Lathe Jones, Navneet Kaur, Steven Langford and Akhil Gupta

Dyes and Pigments, 2019, 170, 107661
DOI: 10.1016/j.dyepig.2019.107661

Coherently degenerate state engineering of organic small molecule materials to generate Wannier excitons

Krishanthi C. Weerasinghe, Tianyang Wang, Junpeng Zhuang, Haiya Sun, Dongzhi Liu, Wei Li, Wenping Hu, Xueqin Zhou and Lichang Wang

Chemical Physics Impact, 2022, 4, 100062
DOI: 10.1016/j.chphi.2022.100062

End group engineering enabling organic solar cells with high open-circuit voltage

Yingping Zou, Chaoyuan Sun, Xiang Xu, Zhixiang Zhou, Xiaoyan Luo, Xinhui Lu, Yunbin Hu, Jun Yuan and Xinxin Xia

J. Phys. D: Appl. Phys., 2022, 55, 374002
DOI: 10.1088/1361-6463/ac77c7

A new medium-bandgap fused-[1]benzothieno[3,2-b][1]benzo-thiophene (BTBT) nonfullerene acceptor for organic solar cells with high open-circuit voltage

Yunchuang Wang, Meijia Chang, Xin Ke, Xiangjian Wan and Guangcheng Yang

Polymer, 2019, 185, 121976
DOI: 10.1016/j.polymer.2019.121976

Effective structural modifications enabled by end-capped effects based on fluorene-core donor, with high open-circuit voltage in organic photovoltaic devices

Chunxiao Hu, Lunxiang Yin, Bao Xie and Yanqin Li

Dyes and Pigments, 2020, 183, 108709
DOI: 10.1016/j.dyepig.2020.108709

Evaluating the Role of Molecular Heredity in the Optical and Electronic Properties of Cross-Conjugated Benzo[1,2-d:4,5-d′]bisoxazoles

David L. Wheeler, Alex V. Diodati, Aimée L. Tomlinson and Malika Jeffries-EL

ACS Omega, 2020, 5, 12374
DOI: 10.1021/acsomega.0c01126

Predicting bond-currents in polybenzenoid hydrocarbons with an additivity scheme

Eno Paenurk, Stefan Feusi and Renana Gershoni-Poranne

The Journal of Chemical Physics, 2021, 154
DOI: 10.1063/5.0038292

Ternary Planar Heterojunction Organic Solar Cells Based on the Ternary Active Layers: α-6T/AlPcCl/C60

Hajar Ftouhi, Hind Lamkaouane, Mustapha Diani, Guy Louarn, Ludovic Arzel, Jean-Christian Bernède, Mohammed Addou and Linda Cattin

Solar, 2022, 2, 375
DOI: 10.3390/solar2030022

Investigation of the different possible energy band structure configurations for planar heterojunction organic solar cells

Hind Lamkaouane, Hajar Ftouhi, Guy Louarn, Yamina Mir, Mustapha Morsli, Mohammed Addou, Linda Cattin and Jean Christian Bernède

Solid-State Electronics, 2022, 191, 108254
DOI: 10.1016/j.sse.2022.108254

Effect of Alkyl Chain Lengths of Highly Crystalline Nonfullerene Acceptors on Open-Circuit Voltage of All-Small-Molecule Organic Solar Cells

Jung-Hwa Park, Jaehoon Kim, Jin Hong Kim, Dong Won Kim, Chi Hyun Ryoo, Oh Kyu Kwon, Changhee Lee, Ji Eon Kwon and Soo Young Park

ACS Appl. Energy Mater., 2021, 4, 259
DOI: 10.1021/acsaem.0c02227

Fullerene/Non-fullerene Alloy for High-Performance All-Small-Molecule Organic Solar Cells

María Privado, Fernando G. Guijarro, Pilar de la Cruz, Rahul Singhal, Fernando Langa and Ganesh D. Sharma

ACS Appl. Mater. Interfaces, 2021, 13, 6461
DOI: 10.1021/acsami.0c21844

Exploration of promising optical and electronic properties of (non-polymer) small donor molecules for organic solar cells

Muhammad Khalid, Muhammad Usman Khan, Saeed Ahmed, Zahid Shafiq, Mohammed Mujahid Alam, Muhammad Imran, Ataualpa Albert Carmo Braga and Muhammad Safwan Akram

Sci Rep, 2021, 11
DOI: 10.1038/s41598-021-01070-3

Synthesis and properties of 5,6-dihydro-4H-cyclopenta[b]thiophene-based nematic liquid crystals: A new access to mesogens with high birefringence and large dielectric anisotropy

Danyang Wan, Xiaozhe Yang, Juanli Li, Minggang Hu, Lingchao Mo, Zhaoyi Che, Qiang Guo, Zhongwei An and Jian Li

Journal of Molecular Liquids, 2021, 327, 114827
DOI: 10.1016/j.molliq.2020.114827

Ground and Excited States of Bis‐4‐Methoxybenzyl‐Substituted Diketopyrrolopyrroles: Spectroscopic and Electrochemical Studies

Alanna S. Murphy, C. Elizabeth Killalea, Joshua Humphreys, Paul A. Hume, Matthew J. Cliffe, Glen J. Murray, E. Stephen Davies, William Lewis and David B. Amabilino

ChemPlusChem, 2019, 84, 1413
DOI: 10.1002/cplu.201900286

Rational design of naphthalimide based small molecules non-fullerene acceptors for organic solar cells

Faiza Jilani, Javed Iqbal, Iza Shahid, Muhammad Yaseen, Muhammad Shabir Mahr, Muhammad Khalid and Khurshid Ayub

Computational and Theoretical Chemistry, 2020, 1187, 112916
DOI: 10.1016/j.comptc.2020.112916

Designing and theoretical characterization of D-π-A1-π-A2 typed organic small molecule donor materials

Lihui Wang, Jinting Ye and Qiang Zhang

Materials Science in Semiconductor Processing, 2022, 152, 107097
DOI: 10.1016/j.mssp.2022.107097

Alkoxy substitution on simple non‐fused electron acceptors for tuning the photoelectric properties of organic solar cells

Lei Wang, Mingwei Cao, Miao Wang, Huanhuan Gao and Qiong Shi

Int J of Quantum Chemistry, 2024, 124
DOI: 10.1002/qua.27254

Hole Transport Materials by Direct C‐H Arylation for Organic Solar Cells: Effect of Structure and Conjugation on Electrical, Optical and Computational Properties

Sheerin Naqvi, Neeraj Chaudhary, Sanchita Singhal, Preeti Yadav and Asit Patra

ChemistrySelect, 2021, 6, 131
DOI: 10.1002/slct.202004241

4,7-di-(2-thienyl)-2,1,3- benzothiadiazole DTBT as active core for synthesizing small molecules to optoelectronic applications: A review

Hanan M.F. Elnagdy

Dyes and Pigments, 2024, 229, 112251
DOI: 10.1016/j.dyepig.2024.112251

Spectroscopic Studies on Intramolecular Charge-Transfer Characteristics in Small-Molecule Organic Solar Cell Donors: A Case Study on ADA and DAD Triad Donors

Hae Yeon Chung, Juwon Oh, Jung-Hwa Park, Illhun Cho, Won Sik Yoon, Ji Eon Kwon, Dongho Kim and Soo Young Park

J. Phys. Chem. C, 2020, 124, 18502
DOI: 10.1021/acs.jpcc.0c06741

Improvement of inverted planar heterojunction solar cells efficiency by using KI/Alq3 hybrid exciton blocking layer

Hind Lamkaouane, Hajar Ftouhi, Mimoun Zazoui, Mohammed Addou, Linda Cattin, Jean-Christian Bernède, Guy Louarn and Yamina Mir

Solid-State Electronics, 2021, 186, 108165
DOI: 10.1016/j.sse.2021.108165

7,7-bis(N, N-diethylethylenediamino)-8,8-dicyanoquinodimethane: Effect of Ethyl Moiety on the Photophysical Property besides Thermal Stability

Anwarhussaini Syed, Sabyashachi Mishra and Subbalakshmi Jayanty

J Fluoresc, 2022, 32, 115
DOI: 10.1007/s10895-021-02830-0

Porphyrin and phthalocyanine heavy metal removal: overview of theoretical investigation for heterojunction organic solar cell applications

Rayene Gara, Mohamed Oussama Zouaghi and Youssef Arfaoui

J Mol Model, 2023, 29
DOI: 10.1007/s00894-023-05659-5

Theoretical Insights into Ultrafast Separation of Photogenerated Charges in a Push‐Pull Polarized Molecular Triad

Kamil Szychta, Mikołaj Martyka and Joanna Jankowska

ChemPhysChem, 2025, 26
DOI: 10.1002/cphc.202400671

Ternary Organic Solar Cell with a Near‐Infrared Absorbing Selenophene–Diketopyrrolopyrrole‐Based Nonfullerene Acceptor and an Efficiency above 10%

María Privado, Prateek Malhotra, Pilar de la Cruz, Rahul Singhal, Jesús Cerdá, Juan Aragó, Enrique Ortí, Ganesh D. Sharma and Fernando Langa

Solar RRL, 2020, 4
DOI: 10.1002/solr.201900471

Fabrication of self-assembly iguratimod prodrug into polymeric nanoparticles delivery for the care of breast cancer therapy

Xue Wang and Bing Wang

mat express, 2023, 13, 1976
DOI: 10.1166/mex.2023.2547

Non‐Fullerene Acceptors with an Extended π‐Conjugated Core: Third Components in Ternary Blends for High‐Efficiency, Post‐Treatment‐Free Organic Solar Cells

Yatzil Alejandra Avalos‐Quiroz, Olivier Bardagot, Yann Kervella, Cyril Aumaître, Lydia Cabau, Agnès Rivaton, Olivier Margeat, Christine Videlot‐Ackermann, Uyxing Vongsaysy, Jörg Ackermann and Renaud Demadrille

ChemSusChem, 2021, 14, 3502
DOI: 10.1002/cssc.202101005

Benzodithiophene-based wide-bandgap small-molecule donors for organic photovoltaics with large open-circuit voltages

Eunhee Lee, Duyen K. Tran, Jihun Park, Wonyoung Ko, Samson A. Jenekhe and Ye-Jin Hwang

Organic Electronics, 2021, 88, 105996
DOI: 10.1016/j.orgel.2020.105996

Unraveling Correlations between Molecular Properties and Device Parameters of Organic Solar Cells Using Machine Learning

Harikrishna Sahu and Haibo Ma

J. Phys. Chem. Lett., 2019, 10, 7277
DOI: 10.1021/acs.jpclett.9b02772

5‐Bromosalicylaldehyde: Theoretical, Experimental and Spectroscopic (FT‐IR, Raman, H1and C13‐NMR, UV‐Vis) Studies and Their Photovoltaic Parameters

Semiha Bahçeli, Ebru Karakaş Sarıkaya and Ömer Dereli

ChemistrySelect, 2024, 9
DOI: 10.1002/slct.202400054

Promising small molecule Pechmann dye analogue donors with low interfacial charge recombination for photovoltaic application: A DFT study

Labanya Bhattacharya, Gautomi Gogoi, Sagar Sharma, Alex Brown and Sridhar Sahu

Materials Today Communications, 2021, 28, 102555
DOI: 10.1016/j.mtcomm.2021.102555

Nano-sized neem plant particles as an electrode for electrochemical storage applications

G. Nagaraj, K.Chinnaiah, Karthik Kannan and K. Gurushankar

Ionics, 2022, 28, 3787
DOI: 10.1007/s11581-022-04618-z

Accepting to Donate: NDI‐Based Small Molecule as a Donor for Bulk Heterojunction Binary Solar Cells

Ruchika Mishra, Sujesh S, Archana V.S, Ayushi Kaushik, Gaurav Gupta, Rahul Singhal, Ganesh D. Sharma and Jeyaraman Sankar

Eur J Org Chem, 2020, 2020, 1603
DOI: 10.1002/ejoc.201901615

Balancing the Voc-Jsc trade-off in polymer solar cells based on 2-(benzoxazol-2-yl)-acetonitrile end-capped small-molecule acceptors through asymmetry and halogenation of end groups

Yalun Zhao, Xuejiao Tang, Jing Cao, Pingping Huang, Chao Weng and Ping Shen

Organic Electronics, 2022, 102, 106446
DOI: 10.1016/j.orgel.2022.106446

Novel Small Four-armed Molecules with Triphenylamine-bridged Structure for Organic Solar Cells Featuring High Open-circuit Voltage

Xiaodong He, Jianling Zhu, Lunxiang Yin, Bao Xie, Kechang Li and Yanqin Li

Chem. Res. Chin. Univ., 2019, 35, 1032
DOI: 10.1007/s40242-019-9179-1

On the quest for solar energy harvesters and nonlinear optics: a DFT exploration of A-D-D-A framework with varying sp2 hybridization

Cihat Güleryüz, Muhammad M. U. Rehman, Abrar U. Hassan, Zainab A. Abass, Ayesha Mohyuddin, Muddassar Zafar and Mohammed T. Alotaibi

J Comput Electron, 2025, 24
DOI: 10.1007/s10825-024-02240-y

Metal Functionalized Diketopyrrolopyrroles: A Promising Class of Materials for Optoelectronic Applications

Yuvraj Patil and Rajneesh Misra

The Chemical Record, 2020, 20, 596
DOI: 10.1002/tcr.201900061

Multiscale Modeling of Broadband Perfect Absorbers Based on Gold Metallic Molecules

Nanda Perdana, Christof Holzer and Carsten Rockstuhl

ACS Omega, 2022, 7, 19337
DOI: 10.1021/acsomega.2c00911

Effect of Alkyl Substituents on DPP‐based Small Molecules for Organic Solar Cells

Eunhee Lim

Bulletin Korean Chem Soc, 2020, 41, 639
DOI: 10.1002/bkcs.12045

End-group modification of terminal acceptors on benzothiadiazole-based BT2F-IC4F molecule to establish efficient organic solar cells

Muhammad Waqas, N.M.A. Hadia, M.M. Hessien, Javed Iqbal, Gaber A.M. Mersal, Shanza Hameed, Ahmed M. Shawky, Zouhaier Aloui, Mahmoud A.A. Ibrahim and Rasheed Ahmad Khera

Journal of Molecular Liquids, 2022, 368, 120770
DOI: 10.1016/j.molliq.2022.120770

Design and structural modification of narrow-bandgap small molecules based on asymmetric porphyrin-diketopyrrolopyrrole backbone for solution-processed organic solar cells

Feiyue Cheng, Xiaodong He, Lunxiang Yin, Bao Xie and Yanqin Li

Dyes and Pigments, 2020, 176, 108211
DOI: 10.1016/j.dyepig.2020.108211

Investigation of aluminum phthalocyanine chloride as acceptor material in planar organic solar cells: comparative study with fullerene

Hajar Ftouhi, Hind Lamkaouane, Guy Louarn, Mustapha Diani, Jean-Christian Bernède, Mohammed Addou and Linda Cattin

J Mater Sci: Mater Electron, 2021, 32, 27710
DOI: 10.1007/s10854-021-07155-z

Benzothiophene semiconductor polymer design by machine learning with low exciton binding energy: A vast chemical space generation for new structures

Shaimaa H. Mallah, Cihat Güleryüz, Sajjad H. Sumrra, Abrar U. Hassan, Hasan Güleryüz, Ayesha Mohyuddin, Hussein A.K. Kyhoiesh, Sadaf Noreen and Ashraf Y. Elnaggar

Materials Science in Semiconductor Processing, 2025, 190, 109331
DOI: 10.1016/j.mssp.2025.109331

Conversion of Radiophotoluminescence Irradiation into Electricity in Photovoltaic Cells. A Review of Theoretical Considerations and Practical Solutions

Agnieszka Iwan, Witalis Pellowski and Krzysztof A. Bogdanowicz

Energies, 2021, 14, 6186
DOI: 10.3390/en14196186

Ternary All‐Small‐Molecule Solar Cells with Two Small‐Molecule Donors and Y6 Nonfullerene Acceptor with a Power Conversion Efficiency over Above 14% Processed from a Nonhalogenated Solvent

Fernando G. Guijarro, Rubén Caballero, Pilar de la Cruz, Rahul Singhal, Fernando Langa and Ganesh D. Sharma

Solar RRL, 2020, 4
DOI: 10.1002/solr.202000460

Dual-Donor-Induced Crystallinity Modulation Enables 19.23% Efficiency Organic Solar Cells

Anhai Liang, Yuqing Sun, Sein Chung, Jiyeong Shin, Kangbo Sun, Chaofeng Zhu, Jingjing Zhao, Zhenmin Zhao, Yufei Zhong, Guangye Zhang, Kilwon Cho and Zhipeng Kan

Nano-Micro Lett., 2025, 17
DOI: 10.1007/s40820-024-01576-1