# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-26T12:56:43+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Energy & Environmental Science') AND volume = 17 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1570432","9.611","0.002","15.13","0.003","21.533","0.005","91.969","0.008","96.72","0.009","101.57","0.009","3041.1","1.1","170","","170","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H85.6 F12 Mg N14 O8 S4 -","- C34 H85.6 F12 Mg N14 O8 S4 -","- C68 H171.2 F24 Mg2 N28 O16 S8 -","2","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","2","630","641","10.1039/D3EE02450D","","","0.71073","MoKα","","0.1099","0.064","","","0.1495","0.1746","","","","","","1.042","","","","has coordinates,has disorder","289562","2024-02-04","12:15:58",""
"1571635","10.7079","0.0001","19.7519","0.0002","21.8828","0.0002","75.619","0.001","85.37","0.001","82.816","0.001","4442.08","0.08","169.98","0.1","169.98","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C94 H78 Cl12 N4 O2 S4 -","- C94 H78 Cl12 N4 O2 S4 -","- C188 H156 Cl24 N8 O4 S8 -","2","1","","Wang, Jianxiao; Li, Yonghai; Han, Chenyu; Chen, Liangliang; Bi, Fuzhen; Hu, Zunyuan; Yang, Chunming; Bao, Xichang; Chu, Junhao","All-polymer solar cells with 19% efficiency via introducing pincer-shaped non-covalent bond interactions","Energy & Environmental Science","2024","17","12","4216","4227","10.1039/D4EE01117A","","x-ray","1.54184","CuKα","","0.0522","0.0461","","","0.1235","0.1286","","","","","","1.062","","","","has coordinates,has disorder","293160","2024-07-05","17:22:22",""
"1571803","20.4033","0.0009","7.8689","0.0003","25.4607","0.0012","90","","91.45","0.002","90","","4086.4","0.3","170","2","170","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C84 H74 F6 N4 O6 S6 -","- C84 H74 F6 N4 O6 S6 -","- C168 H148 F12 N8 O12 S12 -","2","0.5","","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 acceptors via interchain interaction for efficient and stable organic solar cells","Energy & Environmental Science","2024","17","14","5137","5146","10.1039/D4EE02027H","","","1.54178","CuKα","","0.0877","0.0821","","","0.2414","0.2464","","","","","","1.05","","","","has coordinates,has disorder","293876","2024-08-05","19:35:23",""
"1571804","15.606","0.003","16.678","0.003","18.394","0.003","63.176","0.011","69.39","0.014","69.98","0.015","3901.2","1.3","170","2","170.15","","","","","","","","","6","P -1","-P 1","2","","","","- C86 H80 F4 N4 O6 S6 -","- C86 H80 F4 N4 O6 S6 -","- C172 H160 F8 N8 O12 S12 -","2","1","","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 acceptors via interchain interaction for efficient and stable organic solar cells","Energy & Environmental Science","2024","17","14","5137","5146","10.1039/D4EE02027H","","","1.54178","CuKα","","0.2701","0.18","","","0.413","0.4989","","","","","","1.06","","","","has coordinates","293876","2024-08-05","19:35:25",""
"1571805","15.5739","0.0012","18.8499","0.0015","20.1648","0.0013","98.961","0.005","96.362","0.004","98.914","0.005","5721.3","0.7","170","2","170","","","","","","","","","6","P -1","-P 1","2","","","","- C126 H113 F6 N6 O9 S9 -","- C126 H113 F6 N6 O9 S9 -","- C252 H226 F12 N12 O18 S18 -","2","1","","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 acceptors via interchain interaction for efficient and stable organic solar cells","Energy & Environmental Science","2024","17","14","5137","5146","10.1039/D4EE02027H","","","1.54178","CuKα","","0.2413","0.1847","","","0.4266","0.4694","","","","","","1.204","","","","has coordinates","293876","2024-08-05","19:35:25",""
"1572790","20.0971","0.0002","24.3131","0.0002","56.2506","0.0005","90","","90.019","0.001","90","","27485.3","0.4","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C73.67 H61.33 Cl2.67 N7.67 O3.33 S3.33 -","- C75 H61.3333 Cl4 N9 O2 S2 -","- C900 H736 Cl48 N108 O24 S24 -","12","1.5","","Wei, Wenkui; Yuan, Xiyue; Zhong, Jianbin; Wang, Zhiqiang; Zhou, Xia; Zhao, Feixiang; Feng, Dinglong; Zhang, Yue; Chen, Weidi; Yang, Mingqun; Zhang, Wei; Ma, Zaifei; Tang, Zheng; Lu, Xinhui; Huang, Fei; Cao, Yong; Duan, Chunhui","High-efficiency organic solar cells from low-cost pentacyclic fused-ring electron acceptors via crystal engineering","Energy & Environmental Science","2024","17","18","6627","6639","10.1039/D4EE02296C","","","1.54184","CuKα","","0.1299","0.1067","","","0.3237","0.3578","","","","","","1.482","","","","has coordinates","295058","2024-10-04","19:59:13",""
"1572791","14.9787","0.0007","15.6453","0.0007","15.6646","0.0011","85.291","0.004","68.991","0.005","81.688","0.004","3389.1","0.3","149.99","0.1","149.99","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C76 H78 F4 N9 O2 S2 -","- C76 H78 F4 N9 O2 S2 -","- C152 H156 F8 N18 O4 S4 -","2","1","","Wei, Wenkui; Yuan, Xiyue; Zhong, Jianbin; Wang, Zhiqiang; Zhou, Xia; Zhao, Feixiang; Feng, Dinglong; Zhang, Yue; Chen, Weidi; Yang, Mingqun; Zhang, Wei; Ma, Zaifei; Tang, Zheng; Lu, Xinhui; Huang, Fei; Cao, Yong; Duan, Chunhui","High-efficiency organic solar cells from low-cost pentacyclic fused-ring electron acceptors via crystal engineering","Energy & Environmental Science","2024","17","18","6627","6639","10.1039/D4EE02296C","","x-ray","1.54184","CuKα","","0.2217","0.1982","","","0.6373","0.6754","","","","","","1.103","","","","has coordinates","295058","2024-10-04","19:59:20",""
"1572792","24.291","0.0009","23.969","0.002","33.86","0.0012","90","","107.264","0.004","90","","18826.2","1.9","170","0.1","170","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C81 H78 Cl4 F2 N6 O2 S4 -","- C81 H78 Cl4 F2 N6 O2 S4 -","- C648 H624 Cl32 F16 N48 O16 S32 -","8","1","","Gong, Yufei; Zou, Tianwei; Li, Xiaojun; Qin, Shucheng; Sun, Guangpei; Liang, TongLing; Zhou, Ruimin; Zhang, Jianqi; Zhang, Jinyuan; Meng, Lei; Wei, Zhixiang; Li, Yongfang","C-shaped ortho-benzodipyrrole-based acceptors with different electronic effects of top substituents for as-cast green-solvent processed high-performance organic solar cells","Energy & Environmental Science","2024","17","18","6844","6855","10.1039/D4EE02467B","","x-ray","1.54184","CuKα","","0.2216","0.129","","","0.236","0.271","","","","","","1.07","","","","has coordinates","295059","2024-10-04","20:00:14",""
"1572793","24.4208","0.0012","23.6514","0.0017","33.9562","0.0015","90","","107.33","0.005","90","","18722.3","1.9","169.99","0.1","169.99","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C84 H88 Cl4 F N6 O2 S4 -","- C84 H88 Cl4 F N6 O2 S4 -","- C672 H704 Cl32 F8 N48 O16 S32 -","8","1","","Gong, Yufei; Zou, Tianwei; Li, Xiaojun; Qin, Shucheng; Sun, Guangpei; Liang, TongLing; Zhou, Ruimin; Zhang, Jianqi; Zhang, Jinyuan; Meng, Lei; Wei, Zhixiang; Li, Yongfang","C-shaped ortho-benzodipyrrole-based acceptors with different electronic effects of top substituents for as-cast green-solvent processed high-performance organic solar cells","Energy & Environmental Science","2024","17","18","6844","6855","10.1039/D4EE02467B","","x-ray","1.54184","CuKα","","0.2094","0.1256","","","0.2311","0.2651","","","","","","1.043","","","","has coordinates","295059","2024-10-04","20:00:16",""
"1572794","24.5282","0.0011","23.803","0.0018","34.0641","0.0012","90","","107.624","0.004","90","","18954.7","1.8","170","0.1","170","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C87 H97 Cl7 N6 O2 S4 -","- C87 H97 Cl7 N6 O2 S4 -","- C696 H776 Cl56 N48 O16 S32 -","8","1","","Gong, Yufei; Zou, Tianwei; Li, Xiaojun; Qin, Shucheng; Sun, Guangpei; Liang, TongLing; Zhou, Ruimin; Zhang, Jianqi; Zhang, Jinyuan; Meng, Lei; Wei, Zhixiang; Li, Yongfang","C-shaped ortho-benzodipyrrole-based acceptors with different electronic effects of top substituents for as-cast green-solvent processed high-performance organic solar cells","Energy & Environmental Science","2024","17","18","6844","6855","10.1039/D4EE02467B","","x-ray","1.54184","CuKα","","0.2182","0.1353","","","0.2738","0.3096","","","","","","1.027","","","","has coordinates,has disorder","295059","2024-10-04","20:00:17",""