Crystallography Open Database
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Searching journal of publication like 'Energy & environmental science'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1559377 | CIF | C68 H68 Cl2 N4 O4 S2 | P -1 | 14.6444; 15.9434; 17.986 106.356; 113.691; 95.799 | 3578.6 | Li, Xiaojun; Angunawela, Indunil; Chang, Yuan; Zhou, Jiadong; Huang, He; Zhong, Lian; Liebman-Pelaez, Alex; Zhu, Chenhui; Meng, Lei; Xie, Zengqi; Ade, Harald; Yan, He; Li, Yongfang Effect of the chlorine substitution position of the end-group on intermolecular interactions and photovoltaic performance of small molecule acceptors Energy & Environmental Science, 2020, 13, 5028-5038 |
| 1564073 | CIF | C80 H74 F4 N8 O2 S3 | I 1 2/a 1 | 9.93013; 33.0819; 23.3061 90; 94.7559; 90 | 7629.87 | Li, Xiaojun; Luo, Siwei; sun, huiliang; Liu, Tao; Sung, Herman H-Y.; Yu, Han; Xiao, Yiqun; Bai, Fujin; Pan, Mingao; Lu, Xinhui; Williams, Ian Duncan; Guo, Xugang; Li, Yongfang; Yan, He Medium Band-Gap Non-fullerene Acceptors Based on Benzothiophene Donor Moiety Enabling High-Performance Indoor Organic Photovoltaics Energy & Environmental Science, 2021 |
| 1564399 | CIF | C29 H37 Br2 N S3 | P -1 | 13.9722; 17.5232; 19.1562 94.993; 108.44; 91.696 | 4424.4 | Yuan, Xiyue; Zhao, Yunli; Zhan, Tao; Oh, Jiyeon; Zhou, Jiadong; Li, Junyu; Wang, Xiaojing; Wang, Zhiqiang; Pang, Shuting; Cai, Ping; Yang, Changduk; He, Zhicai; Xie, Zengqi; Duan, Chunhui; Huang, Fei; Cao, Yong A donor polymer based on 3-cyanothiophene with superior batch-to-batch reproducibility for high-efficiency organic solar cells Energy & Environmental Science, 2021, 14, 5530-5540 |
| 1564845 | CIF | C90 H102 Cl2 F2 N8 O2 S5 | C 1 2/c 1 | 26.5046; 23.0448; 31.2654 90; 107.646; 90 | 18198.1 | Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency Energy & Environmental Science, 2022, 15, 320-333 |
| 1564846 | CIF | C90 H102 Br2 F2 N8 O2 S5 | C 1 2/c 1 | 26.7059; 23.0515; 31.3331 90; 107.898; 90 | 18355.5 | Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency Energy & Environmental Science, 2022, 15, 320-333 |
| 1564847 | CIF | C90 H102 Br2 Cl2 N8 O2 S5 | P -1 | 16.0896; 17.7032; 17.9514 107.551; 114.327; 90.288 | 4392.9 | Wang, Lai; An, Qiaoshi; Yan, Lu; Bai, Hai-Rui; Jiang, Mengyun; Mahmood, Asif; Yang, Can; Zhi, Hongfu; Wang, Jin-Liang Non-fullerene acceptors with hetero-dihalogenated terminals induce significant difference in single crystallography and enable binary organic solar cells with 17.5% efficiency Energy & Environmental Science, 2022, 15, 320-333 |
| 1565981 | CIF | C100 H108 F6 N8 O2 S5 | P -1 | 16.0665; 17.2536; 17.4364 111.025; 94.188; 96.672 | 4446.7 | Li, Guoping; Feng, Liang-Wen; Mukherjee, Subhrangsu; Jones, Leighton O.; Jacobberger, Robert M.; Huang, Wei; Young, Ryan M.; Pankow, Robert M.; Zhu, Weigang; Lu, Norman; Kohlstedt, Kevin L.; Sangwan, Vinod K.; Wasielewski, Michael R.; Hersam, Mark C.; Schatz, George C.; DeLongchamp, Dean M.; Facchetti, Antonio; Marks, Tobin J. Non-fullerene acceptors with direct and indirect hexa-fluorination afford >17% efficiency in polymer solar cells Energy & Environmental Science, 2022, 15, 645-659 |
| 1565982 | CIF | C98 H102 F6 N8 O2 S5 | P 1 2/c 1 | 24.0563; 25.5964; 43.2943 90; 93.25; 90 | 26615.8 | Li, Guoping; Feng, Liang-Wen; Mukherjee, Subhrangsu; Jones, Leighton O.; Jacobberger, Robert M.; Huang, Wei; Young, Ryan M.; Pankow, Robert M.; Zhu, Weigang; Lu, Norman; Kohlstedt, Kevin L.; Sangwan, Vinod K.; Wasielewski, Michael R.; Hersam, Mark C.; Schatz, George C.; DeLongchamp, Dean M.; Facchetti, Antonio; Marks, Tobin J. Non-fullerene acceptors with direct and indirect hexa-fluorination afford >17% efficiency in polymer solar cells Energy & Environmental Science, 2022, 15, 645-659 |
| 1566632 | CIF | C78 H78 N6 O3 | P -1 | 14.2538; 17.1903; 17.3592 79.038; 72.546; 68.828 | 3767.7 | Fang, Lingyi; Zhang, Yuyan; Ren, Ming; Xie, Xinrui; Li, Tianyu; Yuan, Yi; Zhang, Jing; Wang, Peng A triple helicene based molecular semiconductor characteristic of a fully fused conjugated backbone for perovskite solar cells Energy & Environmental Science, 2022, 15, 1630-1637 |
| 1566850 | CIF | C3 H18 Al F9 O18 S3 | P 21 21 21 | 6.4503; 15.415; 22.904 90; 90; 90 | 2277.38 | Pastel, Glenn R.; Chen, Ying; Pollard, Travis P.; Schroeder, Marshall A.; Bowden, Mark E.; Zheng, Allen; Hahn, Nathan T.; Ma, Lin; Murugesan, Vijayakumar; Ho, Janet; Garaga, Mounesha; Borodin, Oleg; Mueller, Karl; Greenbaum, Steven; Xu, Kang A sobering examination of the feasibility of aqueous aluminum batteries Energy & Environmental Science, 2022, 15, 2460-2469 |
| 1567342 | CIF | C104 H120 Cl6 N8 O2 S4 | P -1 | 15.4157; 17.5066; 19.617 95.374; 102.99; 104.699 | 4925.7 | Zou, Yalu; Chen, Hongbin; Bi, Xingqi; Xu, Xiaoyun; Wang, Hebin; Lin, Menglu; Ma, Zaifei; Zhang, Mingtao; Li, Chenxi; Wan, Xiangjian; Long, Guankui; Zhaoyang, Yao; Chen, Yongsheng Peripheral halogenation engineering controls molecular stacking to enable highly efficient organic solar cells Energy & Environmental Science, 2022, 15, 3519-3533 |
| 1567343 | CIF | C104 H120 F6 N8 O2 S4 | P 1 21/c 1 | 17.222; 59.388; 19.162 90; 98.29; 90 | 19394 | Zou, Yalu; Chen, Hongbin; Bi, Xingqi; Xu, Xiaoyun; Wang, Hebin; Lin, Menglu; Ma, Zaifei; Zhang, Mingtao; Li, Chenxi; Wan, Xiangjian; Long, Guankui; Zhaoyang, Yao; Chen, Yongsheng Peripheral halogenation engineering controls molecular stacking to enable highly efficient organic solar cells Energy & Environmental Science, 2022, 15, 3519-3533 |
| 1567344 | CIF | C104 H120 Cl4 F2 N8 O2 S4 | R 3 c :H | 41.303; 41.303; 32.517 90; 90; 120 | 48040 | Zou, Yalu; Chen, Hongbin; Bi, Xingqi; Xu, Xiaoyun; Wang, Hebin; Lin, Menglu; Ma, Zaifei; Zhang, Mingtao; Li, Chenxi; Wan, Xiangjian; Long, Guankui; Zhaoyang, Yao; Chen, Yongsheng Peripheral halogenation engineering controls molecular stacking to enable highly efficient organic solar cells Energy & Environmental Science, 2022, 15, 3519-3533 |
| 1567503 | CIF | C26 H22 Cl2 N8 O8 Ru | P b c n | 8.1943; 21.1329; 16.5436 90; 90; 90 | 2864.8 | Pokhrel, Indira; Reddy, Guda Dinneswara; Kwon, Taejin; Choi, Eungyeong; Chun, Yu Sung; Lee, Sang Tak; Sung, Bong June; Lee, Duck Hyung; Bin Oh, Han; Yoon, Kyung Byung Insights into the directions to increase turnover frequency and turnover number during photochemical water oxidation with molecular Ru catalysts Energy & Environmental Science, 2022, 15, 4259-4288 |
| 1567504 | CIF | C24 H24 Cl2 N10 O8 Ru | C 1 2/c 1 | 17.8962; 10.2796; 15.9597 90; 90.899; 90 | 2935.68 | Pokhrel, Indira; Reddy, Guda Dinneswara; Kwon, Taejin; Choi, Eungyeong; Chun, Yu Sung; Lee, Sang Tak; Sung, Bong June; Lee, Duck Hyung; Bin Oh, Han; Yoon, Kyung Byung Insights into the directions to increase turnover frequency and turnover number during photochemical water oxidation with molecular Ru catalysts Energy & Environmental Science, 2022, 15, 4259-4288 |
| 1567505 | CIF | C30 H29 F12 N9 P2 Ru | P -1 | 8.2606; 10.798; 20.5518 77.5866; 84.0528; 84.8406 | 1776.36 | Pokhrel, Indira; Reddy, Guda Dinneswara; Kwon, Taejin; Choi, Eungyeong; Chun, Yu Sung; Lee, Sang Tak; Sung, Bong June; Lee, Duck Hyung; Bin Oh, Han; Yoon, Kyung Byung Insights into the directions to increase turnover frequency and turnover number during photochemical water oxidation with molecular Ru catalysts Energy & Environmental Science, 2022, 15, 4259-4288 |
| 1567669 | CIF | C74 H44 F4 N8 O3 S5 | C 1 2/c 1 | 23.7933; 57.27; 13.4957 90; 109.688; 90 | 17314.8 | Luo, Zhenghui; Gao, Yuan; Lai, Hanjian; Li, Yuxiang; Wu, Ziang; Chen, Zhanxiang; Sun, Rui; Ren, Jiaqi; Zhang, Cai’e; He, Feng; Woo, HanYoung; Min, Jie; Yang, Chuluo Asymmetric side-chain substitution enables a 3D network acceptor with hydrogen bond assisted crystal packing and enhanced electronic coupling for efficient organic solar cells Energy & Environmental Science, 2022, 15, 4601-4611 |
| 1567670 | CIF | C58 H44 F0.5 N16 O4.5 S5 | P -1 | 13.457; 23.14; 30.127 70.475; 86.756; 80.476 | 8720 | Luo, Zhenghui; Gao, Yuan; Lai, Hanjian; Li, Yuxiang; Wu, Ziang; Chen, Zhanxiang; Sun, Rui; Ren, Jiaqi; Zhang, Cai’e; He, Feng; Woo, HanYoung; Min, Jie; Yang, Chuluo Asymmetric side-chain substitution enables a 3D network acceptor with hydrogen bond assisted crystal packing and enhanced electronic coupling for efficient organic solar cells Energy & Environmental Science, 2022, 15, 4601-4611 |
| 1568456 | CIF | C88 H78 Br4 N4 O2 S8 | P -1 | 8.7612; 13.2409; 17.624 93.211; 98.646; 97.221 | 1999.4 | Zhu, Weigang; Li, Guoping; Mukherjee, Subhrangsu; Powers-Riggs, Natalia E.; Jones, Leighton O.; Gann, Eliot; Kline, R. Joseph; Herzing, Andrew; Logsdon, Jenna L.; Flagg, Lucas; Stern, Charlotte L.; Young, Ryan M.; Kohlstedt, Kevin L.; Schatz, George C.; DeLongchamp, Dean M.; Wasielewski, Michael R.; Melkonyan, Ferdinand S.; Facchetti, Antonio; Marks, Tobin J. Quantitative relationships between film morphology, charge carrier dynamics, and photovoltaic performance in bulk-heterojunction binary vs. ternary acceptor blends Energy & Environmental Science, 2023, 16, 1234-1250 |
| 1568932 | CIF | H76 Li14 Na O148 P5 W30 | C 1 2/m 1 | 27.159; 21.1739; 23.6358 90; 95.848; 90 | 13521.3 | Zhao, Tingting; Bell, Nicola L.; Chisholm, Greig; Kandasamy, Balamurugan; Long, De-Liang; Cronin, Leroy Aqueous solutions of super reduced polyoxotungstates as electron storage systems. Energy & environmental science, 2023, 16, 2603-2610 |
| 1569354 | CIF | C104 H110 F6 N8 O2 S4 | P 1 2/n 1 | 24.3943; 14.1219; 29.0635 90; 103.837; 90 | 9721.6 | Xie, Meiling; Shi, Yanan; Zhu, Lingyun; Zhang, Jianqi; Cheng, Qian; Zhang, Hao; Yan, Yangjun; Zhu, Mingquan; Zhou, Huiqiong; Lu, Kun; Wei, Zhixiang Selective halogenation of central and end-units of nonfullerene acceptors enables enhanced molecular packing and photovoltaic performance Energy & Environmental Science, 2023, 16, 3543-3551 |
| 1569355 | CIF | C104 H110 F6 N8 O2 S4 | P 1 21/c 1 | 22.0344; 27.1704; 38.5671 90; 98.0928; 90 | 22859.5 | Xie, Meiling; Shi, Yanan; Zhu, Lingyun; Zhang, Jianqi; Cheng, Qian; Zhang, Hao; Yan, Yangjun; Zhu, Mingquan; Zhou, Huiqiong; Lu, Kun; Wei, Zhixiang Selective halogenation of central and end-units of nonfullerene acceptors enables enhanced molecular packing and photovoltaic performance Energy & Environmental Science, 2023, 16, 3543-3551 |
| 1569909 | CIF | C39 H27 N3 | P -3 | 19.8544; 19.8544; 16.6635 90; 90; 120 | 5688.7 | Fang, Lingyi; Zhang, Yuyan; Cai, Yaohang; Zhang, Jing; Wei, Yuefang; Yuan, Yi; Wang, Peng Solution-processable organic semiconductors with over 220 °C glass transition temperature: manipulating morphology using a helical polycyclic heteroaromatic motif Energy & Environmental Science, 2023, 16, 5231-5242 |
| 1569910 | CIF | C39 H27 N3 | R -3 :H | 18.0704; 18.0704; 16.2498 90; 90; 120 | 4595.3 | Fang, Lingyi; Zhang, Yuyan; Cai, Yaohang; Zhang, Jing; Wei, Yuefang; Yuan, Yi; Wang, Peng Solution-processable organic semiconductors with over 220 °C glass transition temperature: manipulating morphology using a helical polycyclic heteroaromatic motif Energy & Environmental Science, 2023, 16, 5231-5242 |
| 1569911 | CIF | C54 H57 N3 | P 1 21/c 1 | 13.117; 53.4561; 12.9832 90; 113.512; 90 | 8347.8 | Fang, Lingyi; Zhang, Yuyan; Cai, Yaohang; Zhang, Jing; Wei, Yuefang; Yuan, Yi; Wang, Peng Solution-processable organic semiconductors with over 220 °C glass transition temperature: manipulating morphology using a helical polycyclic heteroaromatic motif Energy & Environmental Science, 2023, 16, 5231-5242 |
| 1570145 | CIF | C112 H72 Cl4 N4 O2 S4 | P 1 21/c 1 | 8.7351; 19.5191; 26.799 90; 97.543; 90 | 4529.7 | Lai, Hanjian; Chen, Hui; Chen, Zi-Yi; Lang, Yongwen; Zhu, Yulin; Zhang, Shi-Tong; Lai, Xue; Tan, Pu; Zhang, Yuanzhu; Yang, Bing; Li, Gang; He, Feng Exploring the significance of packing modes and 3D framework sizes and utilizing three chlorine-mediated acceptors and the “like dissolves like” approach for achieving an efficiency over 19% Energy & Environmental Science, 2023, 16, 5944-5955 |
| 1570146 | CIF | C62.5 H28 Br Cl4 N8 O3 S5 | C 1 2/c 1 | 24.082; 57.855; 13.8091 90; 104.745; 90 | 18606 | Lai, Hanjian; Chen, Hui; Chen, Zi-Yi; Lang, Yongwen; Zhu, Yulin; Zhang, Shi-Tong; Lai, Xue; Tan, Pu; Zhang, Yuanzhu; Yang, Bing; Li, Gang; He, Feng Exploring the significance of packing modes and 3D framework sizes and utilizing three chlorine-mediated acceptors and the “like dissolves like” approach for achieving an efficiency over 19% Energy & Environmental Science, 2023, 16, 5944-5955 |
| 1570147 | CIF | C62 H28 Cl4 N8 O2 S5 | C 1 2/c 1 | 26.6758; 22.3323; 29.799 90; 105.664; 90 | 17093 | Lai, Hanjian; Chen, Hui; Chen, Zi-Yi; Lang, Yongwen; Zhu, Yulin; Zhang, Shi-Tong; Lai, Xue; Tan, Pu; Zhang, Yuanzhu; Yang, Bing; Li, Gang; He, Feng Exploring the significance of packing modes and 3D framework sizes and utilizing three chlorine-mediated acceptors and the “like dissolves like” approach for achieving an efficiency over 19% Energy & Environmental Science, 2023, 16, 5944-5955 |
| 1570148 | CIF | C77 H56 Cl4 N8 O3 S5 | P -1 | 11.4138; 18.519; 20.916 97.168; 104.322; 107.723 | 3983.3 | Lai, Hanjian; Chen, Hui; Chen, Zi-Yi; Lang, Yongwen; Zhu, Yulin; Zhang, Shi-Tong; Lai, Xue; Tan, Pu; Zhang, Yuanzhu; Yang, Bing; Li, Gang; He, Feng Exploring the significance of packing modes and 3D framework sizes and utilizing three chlorine-mediated acceptors and the “like dissolves like” approach for achieving an efficiency over 19% Energy & Environmental Science, 2023, 16, 5944-5955 |
| 1570149 | CIF | C60.83 H25.65 Br1.67 Cl4 N8 O2 S5 | C 1 2/c 1 | 24.068; 59.021; 13.648 90; 101.855; 90 | 18974 | Lai, Hanjian; Chen, Hui; Chen, Zi-Yi; Lang, Yongwen; Zhu, Yulin; Zhang, Shi-Tong; Lai, Xue; Tan, Pu; Zhang, Yuanzhu; Yang, Bing; Li, Gang; He, Feng Exploring the significance of packing modes and 3D framework sizes and utilizing three chlorine-mediated acceptors and the “like dissolves like” approach for achieving an efficiency over 19% Energy & Environmental Science, 2023, 16, 5944-5955 |
| 1570150 | CIF | C116 H154 F2 N2 O4 S12 Si2 | P -1 | 12.5553; 14.6952; 16.332 82.201; 85.712; 75.234 | 2884.29 | Xu, Tongle; Lv, Jie; Zheng, Daming; Luo, Zhenghui; Jee, Min Hun; Ran, Guangliu; Chen, Zhanxiang; Huang, Zhongyan; Ren, Jiaqi; Li, Yuxiang; Zhang, Cai’e; Hu, Hanlin; Pauporté, Thierry; Zhang, Wenkai; Woo, Han Young; Yang, Chuluo Regulating the reorganization energy and crystal packing of small-molecule donors enables the high performance of binary all-small-molecule organic solar cells with a slow film growth rate Energy & Environmental Science, 2023, 16, 5933-5943 |
| 1570151 | CIF | C108 H140 Cl2 N2 O2 S12 Si2 | P -1 | 9.8191; 14.0215; 20.6969 76.135; 82.232; 80.174 | 2712.64 | Xu, Tongle; Lv, Jie; Zheng, Daming; Luo, Zhenghui; Jee, Min Hun; Ran, Guangliu; Chen, Zhanxiang; Huang, Zhongyan; Ren, Jiaqi; Li, Yuxiang; Zhang, Cai’e; Hu, Hanlin; Pauporté, Thierry; Zhang, Wenkai; Woo, Han Young; Yang, Chuluo Regulating the reorganization energy and crystal packing of small-molecule donors enables the high performance of binary all-small-molecule organic solar cells with a slow film growth rate Energy & Environmental Science, 2023, 16, 5933-5943 |
| 1570432 | CIF | C34 H85.6 F12 Mg N14 O8 S4 | P -1 | 9.611; 15.13; 21.533 91.969; 96.72; 101.57 | 3041.1 | Wang, Min; Sun, Wenhao; Zhang, Kun; Zhang, Zhonghua; Du, Aobing; Dong, Shanmu; Zhang, Jinlei; Liu, Jing; Chen, Xi; Zhou, Zhenfang; Li, Fujun; Li, Zhenjiang; Li, Guicun; Cui, Guanglei Synergy between the coordination and trace ionization of co-solvents enables reversible magnesium electroplating/stripping behavior Energy & Environmental Science, 2024, 17, 630-641 |
| 1571635 | CIF | C94 H78 Cl12 N4 O2 S4 | P -1 | 10.7079; 19.7519; 21.8828 75.619; 85.37; 82.816 | 4442.08 | Wang, Jianxiao; Li, Yonghai; Han, Chenyu; Chen, Liangliang; Bi, Fuzhen; Hu, Zunyuan; Yang, Chunming; Bao, Xichang; Chu, Junhao 19% Efficiency All-Polymer Solar Cells via Introducing Pincer-Shaped Non-covalent Bond Interactions Energy & Environmental Science, 2024 |
| 1571803 | CIF | C84 H74 F6 N4 O6 S6 | P 1 21/c 1 | 20.4033; 7.8689; 25.4607 90; 91.45; 90 | 4086.4 | Ye, Shounuan; Chen, Tianyi; Yu, Jinyang; Wang, Shanlu; Li, Shuixing; Wang, Jingxi; Fu, Yuang; Zhu, Yuxuan; Wang, Mengting; Lu, Xinhui; Ma, Zaifei; Li, Chang-Zhi; Shi, Minmin; Chen, Hongzheng Enhanced crystal network and charge transfer of non-fused ring electron acceptor via interchain interaction enable efficient and stable organic solar cells Energy & Environmental Science, 2024 |
| 1571804 | CIF | C86 H80 F4 N4 O6 S6 | P -1 | 15.606; 16.678; 18.394 63.176; 69.39; 69.98 | 3901.2 | Ye, Shounuan; Chen, Tianyi; Yu, Jinyang; Wang, Shanlu; Li, Shuixing; Wang, Jingxi; Fu, Yuang; Zhu, Yuxuan; Wang, Mengting; Lu, Xinhui; Ma, Zaifei; Li, Chang-Zhi; Shi, Minmin; Chen, Hongzheng Enhanced crystal network and charge transfer of non-fused ring electron acceptor via interchain interaction enable efficient and stable organic solar cells Energy & Environmental Science, 2024 |
| 1571805 | CIF | C126 H113 F6 N6 O9 S9 | P -1 | 15.5739; 18.8499; 20.1648 98.961; 96.362; 98.914 | 5721.3 | Ye, Shounuan; Chen, Tianyi; Yu, Jinyang; Wang, Shanlu; Li, Shuixing; Wang, Jingxi; Fu, Yuang; Zhu, Yuxuan; Wang, Mengting; Lu, Xinhui; Ma, Zaifei; Li, Chang-Zhi; Shi, Minmin; Chen, Hongzheng Enhanced crystal network and charge transfer of non-fused ring electron acceptor via interchain interaction enable efficient and stable organic solar cells Energy & Environmental Science, 2024 |
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