# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-10-18T04:51:12+02:00
# 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 'Materials horizons') AND volume = 9 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
"1564427","19.525","0.01","9.546","0.006","20.594","0.013","90","","114.38","0.02","90","","3496","4","170","2","170","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C50 H34 N2 -","- C50 H34 N2 -","- C200 H136 N8 -","4","1","","Han, Pengbo; Lin, Chengwei; Wang, Kaojin; Qiu, Yanping; Wu, Haozhong; Qin, Anjun; Ma, Dongge; Tang, Ben Zhong","Aggregation-induced emission luminogen with excellent triplet-triplet upconversion efficiency for highly efficient non-doped blue organic light-emitting diodes.","Materials horizons","2022","9","1","376","382","10.1039/d1mh01129d","","","0.71073","MoKα","","0.0593","0.0438","","","0.097","0.1066","","","","","","1.066","","","","has coordinates","272793","2022-02-04","20:05:58",""
"1564683","8.321","0.003","9.678","0.004","9.879","0.004","94.541","0.006","96.864","0.006","94.634","0.006","784.1","0.5","293.15","","293.15","","","","","","","","","2","P -1","-P 1","2","","TPM","","- C21 H18 -","- C21 H18 -","- C42 H36 -","2","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.081","0.0584","","","0.1754","0.1992","","","","","","1.044","","","","has coordinates","272792","2022-02-04","20:05:49",""
"1564684","8.773","0.004","9.273","0.005","20.333","0.01","90","","90.317","0.008","90","","1654.1","1.4","296.15","","296.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","TPMBr","","- C21 H17 Br -","- C21 H17 Br -","- C84 H68 Br4 -","4","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.0826","0.05","","","0.1061","0.1182","","","","","","1.045","","","","has coordinates","272792","2022-02-04","20:05:49",""
"1564685","31.9","0.03","8.761","0.009","5.796","0.006","90","","90","","90","","1620","3","296","2","296.15","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C21 H15 F3 -","- C21 H15 F3 -","- C84 H60 F12 -","4","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.0769","0.0636","","","0.1387","0.1444","","","","","","1.133","","","","has coordinates","277994","2022-09-20","08:32:41",""
"1564686","13.672","0.005","7.976","0.003","16.909","0.006","90","","99.786","0.006","90","","1817.1","1.2","296.15","","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 Br F3 -","- C21 H14 Br F3 -","- C84 H56 Br4 F12 -","4","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.168","0.0743","","","0.1737","0.2098","","","","","","1.029","","","","has coordinates,has disorder","272792","2022-02-04","20:05:49",""
"1564687","12.88","0.009","8.745","0.006","18.874","0.01","90","","121.39","0.03","90","","1815","2","296","2","296.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 Br2 -","- C21 H16 Br2 -","- C84 H64 Br8 -","4","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.2159","0.1325","","","0.2379","0.2764","","","","","","1.048","","","","has coordinates","272792","2022-02-04","20:05:49",""
"1564688","16.448","0.005","6.0973","0.0019","19.528","0.006","90","","105.073","0.005","90","","1891.1","1","296","2","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H13 Br2 F3 -","- C21 H13 Br2 F3 -","- C84 H52 Br8 F12 -","4","1","","Fan, Yunhao; Han, Mengmeng; Huang, Arui; Liao, Qiuyan; Tu, Jin; Liu, Xiuxing; Huang, Bohan; Li, Qianqian; Li, Zhen","Multi-photoresponsive triphenylethylene derivatives with photochromism, photodeformation and room temperature phosphorescence.","Materials horizons","2022","9","1","368","375","10.1039/d1mh01207j","","","0.71073","MoKα","","0.1429","0.0685","","","0.1851","0.2271","","","","","","1.031","","","","has coordinates,has disorder","272792","2022-02-04","20:05:49",""
"1565020","11.7514","0.0012","17.3977","0.0017","19.925","0.002","102.675","0.006","98.649","0.006","99.031","0.005","3852.2","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C83 H89 F4 N9 O3 S2 Se2 -","- C83 H89 F4 N9 O3 S2 Se2 -","- C166 H178 F8 N18 O6 S4 Se4 -","2","1","","Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.","Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.","Materials horizons","2022","9","1","403","410","10.1039/d1mh01127h","","x-ray","0.71073","MoKα","","0.1415","0.0774","","","0.2064","0.2464","","","","","","1.053","","","","has coordinates,has disorder","272791","2022-02-04","20:05:37",""
"1565021","18.8244","0.0012","29.3244","0.0018","31.439","0.002","90","","95.951","0.003","90","","17261.2","1.9","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C88 H99 F4 N9 O3 S2 Se2 -","- C88 H99 F4 N9 O3 S2 Se2 -","- C704 H792 F32 N72 O24 S16 Se16 -","8","1","","Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.","Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.","Materials horizons","2022","9","1","403","410","10.1039/d1mh01127h","","x-ray","0.71073","MoKα","","0.1362","0.0702","","","0.1925","0.2391","","","","","","1.03","","","","has coordinates,has disorder","272791","2022-02-04","20:05:38",""
"1565022","13.938","0.001","52.166","0.002","31.942","0.001","90","","99.927","0.003","90","","22877","2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C81 H85 F4 N9 O2 S2 Se2 -","- C81 H85 F4 N9 O2 S2 Se2 -","- C972 H1020 F48 N108 O24 S24 Se24 -","12","3","","Qi, Feng; Jones, Leighton O.; Jiang, Kui; Jang, Sei-Hum; Kaminsky, Werner; Oh, Jiyeon; Zhang, Hongna; Cai, Zongwei; Yang, Changduk; Kohlstedt, Kevin L.; Schatz, George C.; Lin, Francis R.; Marks, Tobin J.; Jen, Alex K.-Y.","Regiospecific <i>N</i>-alkyl substitution tunes the molecular packing of high-performance non-fullerene acceptors.","Materials horizons","2022","9","1","403","410","10.1039/d1mh01127h","","x-ray","0.71073","MoKα","","0.3045","0.1209","","","0.2666","0.3277","","","","","","1.077","","","","has coordinates","272791","2022-02-04","20:05:38",""
"1565122","6.0023","0.0002","8.1084","0.0002","24.3715","0.0005","98.319","0.002","94.455","0.002","92.83","0.002","1167.9","0.05","100","2","100","2","","","","","","","","3","P 1","P 1","1","","","","- C30 H28 S2 -","- C30 H28 S2 -","- C60 H56 S4 -","2","2","","Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo","Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.","Materials horizons","2022","9","1","444","451","10.1039/d1mh01119g","","x-ray","1.54184","CuKα","","0.0722","0.0598","","","0.1628","0.1748","","","","","","1.043","","","","has coordinates","275856","2022-06-07","07:08:28",""
"1565123","6.0173","0.0001","8.1041","0.0002","24.3262","0.0005","98.542","0.002","94.452","0.002","92.932","0.002","1167.2","0.04","100","2","100","2","","","","","","","","3","P 1","P 1","1","","","","- C30 H28 S2 -","- C30 H28 S2 -","- C60 H56 S4 -","2","2","","Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo","Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties.","Materials horizons","2022","9","1","444","451","10.1039/d1mh01119g","","","1.54184","CuKα","","0.065","0.0622","","","0.1662","0.1684","","","","","","1.09","","","","has coordinates","272790","2022-02-04","20:05:15",""
"1565386","12.661","0.003","12.337","0.002","5.0928","0.0011","90","","90","","90","","795.5","0.3","655","2","655","2","","","","","","","","2","C m m a","-C 2a 2","67","","","","- Al2.69 B50 -","- Al2.686 B50 -","- Al5.372 B100 -","2","0.125","","Zheng, Xu; Yan, Dayu; Yi, Changjiang; Zhu, Jinlong; Zhang, Qinghua; Zhai, Junyi; Ma, Teng; Zhu, Pinwen; Li, Hui; Gu, Lin; Zhao, Yusheng; Yao, Yugui; Shi, Youguo; Yu, Xiaohui; Jin, Changqing","The discovery of a superhard P-type transparent semiconductor: Al<sub>2.69</sub>B<sub>50</sub>.","Materials horizons","2022","9","2","748","755","10.1039/d1mh00975c","","","0.71073","MoKα","","0.0667","0.0555","","","0.1538","0.1633","","","","","","1.028","","","","has coordinates,has disorder","273437","2022-03-04","22:27:56",""
"1565433","8.1464","0.0003","11.8837","0.0004","25.5753","0.0009","83.931","0.001","83.143","0.001","86.209","0.001","2440.85","0.15","296.15","","296.15","","","","","","","","","4","P -1","-P 1","2","","","","- C48 H41 Cl9 N6 -","- C48 H41 Cl9 N6 -","- C96 H82 Cl18 N12 -","2","1","","He, Jian-Li; Tang, Yukun; Zhang, Kai; Zhao, Yue; Lin, Yu-Ching; Hsu, Chih-Kai; Chen, Chia-Hsun; Chiu, Tien-Lung; Lee, Jiun-Haw; Wang, Chuan-Kui; Wu, Chung-Chih; Fan, Jian","An extended π-backbone for highly efficient near-infrared thermally activated delayed fluorescence with enhanced horizontal molecular orientation.","Materials horizons","2022","9","2","772","779","10.1039/d1mh01651b","","","0.71073","MoKα","","0.1306","0.0813","","","0.2098","0.2512","","","","","","1.041","","","","has coordinates,has disorder","273436","2022-03-04","22:27:43",""
"1565832","7.3775","0.0004","9.3783","0.0006","9.4318","0.0006","61.214","0.002","89.717","0.002","73.611","0.002","542","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Anthracene-DTTCNQ","","- C30 H14 N4 S2 -","- C30 H14 N4 S2 -","- C30 H14 N4 S2 -","1","0.5","","Jiang, Hui; Ye, Jun; Hu, Peng; Zhu, Shengli; Liang, Yanqin; Cui, Zhenduo; Kloc, Christian; Hu, Wenping","Growth direction dependent separate-channel charge transport in the organic weak charge-transfer co-crystal of anthracene-DTTCNQ.","Materials horizons","2022","9","3","1057","1067","10.1039/d1mh01767e","","","0.71073","MoKα","","0.1006","0.0687","","","0.1285","0.1415","","","","","","1.135","","","","has coordinates,has disorder","275077","2022-05-05","20:57:58",""
"1566113","13.3376","0.00016","15.8984","0.00019","16.7118","0.0002","86.2207","0.001","87.3777","0.001","69.0861","0.0011","3302.08","0.07","125","","125","","","","","","","","","4","P -1","-P 1","2","","","","- C75 H67 N2 O -","- C75 H65 N2 O -","- C150 H130 N4 O2 -","2","1","","Hall, David; Stavrou, Kleitos; Duda, Eimantas; Danos, Andrew; Bagnich, Sergey; Warriner, Stuart; Slawin, Alexandra M. Z.; Beljonne, David; Köhler, Anna; Monkman, Andrew; Olivier, Yoann; Zysman-Colman, Eli","Diindolocarbazole - achieving multiresonant thermally activated delayed fluorescence without the need for acceptor units.","Materials horizons","2022","9","3","1068","1080","10.1039/d1mh01383a","","","1.54184","CuKα","","0.1545","0.151","","","0.5146","0.5275","","","","","","2.941","","","","has coordinates","275078","2022-05-05","20:58:09",""
"1566114","8.24799","0.00012","14.1901","0.00018","28.3417","0.0004","90","","90.5962","0.0013","90","","3316.93","0.08","173","","173","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C45 H41 N -","- C45 H41 N -","- C180 H164 N4 -","4","1","","Hall, David; Stavrou, Kleitos; Duda, Eimantas; Danos, Andrew; Bagnich, Sergey; Warriner, Stuart; Slawin, Alexandra M. Z.; Beljonne, David; Köhler, Anna; Monkman, Andrew; Olivier, Yoann; Zysman-Colman, Eli","Diindolocarbazole - achieving multiresonant thermally activated delayed fluorescence without the need for acceptor units.","Materials horizons","2022","9","3","1068","1080","10.1039/d1mh01383a","","","1.54184","CuKα","","0.0463","0.0424","","","0.1157","0.1187","","","","","","0.996","","","","has coordinates","275078","2022-05-05","20:58:10",""
"1566610","10.9208","0.0004","10.9208","0.0004","6.1774","0.0003","90","","90","","120","","638.04","0.05","293","2","293","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","[K3Cl][Mn2Ga6S12]","","","- Cl Ga6 K3 Mn2 S12 -","- Cl Ga6 K3 Mn2 S12 -","- Cl Ga6 K3 Mn2 S12 -","1","0.166667","","Liu, Bin-Wen; Pei, Shao-Min; Jiang, Xiao-Ming; Guo, Guo-Cong","Broad transparency and wide band gap achieved in a magnetic infrared nonlinear optical chalcogenide by suppressing d-d transitions.","Materials horizons","2022","9","5","1513","1517","10.1039/d2mh00060a","","","0.71073","MoKα","","0.0364","0.0358","","","0.096","0.0962","","","","","","1.096","","","","has coordinates","275835","2022-06-06","02:08:12",""
"1566920","10.891","0.0007","11.4276","0.0008","11.5284","0.0009","116.793","0.007","90.271","0.006","101.247","0.006","1249.11","0.18","300","","300","","","","","","","","","3","P -1","-P 1","2","","(Z)-1,2-bis(3,4-dimethoxyphenyl)-1,2-diphenylethene","","- C30 H28 O4 -","- C30 H28 O4 -","- C60 H56 O8 -","2","1","","Zhang, Qiao; Wang, Wenbo; Cai, Changyong; Wu, Shuanggen; Li, Jialing; Li, Fenfang; Dong, Shengyi","Underwater luminescent labeling materials constructed from a supramolecular approach.","Materials horizons","2022","9","7","1984","1991","10.1039/d2mh00211f","","x-ray","1.54184","CuKα","","0.0718","0.0526","","","0.1301","0.1487","","","","","","1.009","","","","has coordinates","276678","2022-07-06","08:39:42",""
"1566921","7.8756","0.0005","11.8787","0.0007","13.8525","0.0008","84.512","0.002","84.625","0.002","71.646","0.002","1221.59","0.13","153","","153","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H28 O4 -","- C30 H28 O4 -","- C60 H56 O8 -","2","1","","Zhang, Qiao; Wang, Wenbo; Cai, Changyong; Wu, Shuanggen; Li, Jialing; Li, Fenfang; Dong, Shengyi","Underwater luminescent labeling materials constructed from a supramolecular approach.","Materials horizons","2022","9","7","1984","1991","10.1039/d2mh00211f","","","1.54178","CuKα","","0.0504","0.0481","","","0.1239","0.1259","","","","","","1.032","","","","has coordinates","276678","2022-07-06","08:39:54",""
"1567388","5.8166","0.0001","11.4718","0.0002","9.5696","0.0002","90","","103.897","0.002","90","","619.86","0.02","100.2","0.8","100.2","0.8","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C12 H22 N O3 -","- C12 H22 N O3 -","- C24 H44 N2 O6 -","2","0.5","","Wang, Zhaoyu; Zou, Xinhui; Xie, Yi; Zhang, Haoke; Hu, Lianrui; Chan, Christopher C. S.; Zhang, Ruoyao; Guo, Jing; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Williams, Ian D.; Zeng, Zebing; Wong, Kam Sing; Sherrill, C. David; Ye, Ruquan; Tang, Ben Zhong","A nonconjugated radical polymer with stable red luminescence in the solid state.","Materials horizons","2022","9","10","2564","2571","10.1039/d2mh00808d","","x-ray","1.54184","CuKα","","0.0368","0.0357","","","0.0924","0.0931","","","","","","1.047","","","","has coordinates,has disorder","278480","2022-10-07","01:26:37",""
"1567481","14.234","0.002","19.457","0.003","12.568","0.002","90","","100.195","0.007","90","","3425.8","0.9","151","2","151","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H30 B N3 -","- C48 H30 B N3 -","- C192 H120 B4 N12 -","4","1","","He, Shuang; Liu, Junjie; Yang, Ge; Bin, Zhengyang; You, Jingsong","Dipole moment engineering enables universal B-N-embedded bipolar hosts for OLEDs: an old dog learns a new trick.","Materials horizons","2022","9","11","2818","2823","10.1039/d2mh00856d","","","0.71073","MoKα","","0.0749","0.0503","","","0.1126","0.1277","","","","","","1.026","","","","has coordinates","279030","2022-11-07","05:56:28",""
"1567482","27.5838","0.0011","9.1201","0.0004","19.3361","0.0009","90","","124.586","0.001","90","","4004.7","0.3","302","2","302","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C54 H42 B N3 -","- C54 H42 B N3 -","- C216 H168 B4 N12 -","4","0.5","","He, Shuang; Liu, Junjie; Yang, Ge; Bin, Zhengyang; You, Jingsong","Dipole moment engineering enables universal B-N-embedded bipolar hosts for OLEDs: an old dog learns a new trick.","Materials horizons","2022","9","11","2818","2823","10.1039/d2mh00856d","","","0.71073","MoKα","","0.0946","0.046","","","0.0994","0.1185","","","","","","1.029","","","","has coordinates","279030","2022-11-07","05:56:28",""