# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-28T17:34:05+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 'The journal of physical chemistry letters') AND volume = 12 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
"8000473","13.7963","0.0005","12.6757","0.0004","13.3735","0.0005","90","","98.305","0.0012","90","","2314.2","0.14","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","compound 3","7,12-dicyano-3,16-dimethoxyheptahelicene","","- C34 H20 N2 O2 -","- C34 H20 N2 O2 -","- C136 H80 N8 O8 -","4","0.5","","Kubo, Hiromu; Hirose, Takashi; Nakashima, Takuya; Kawai, Tsuyoshi; Hasegawa, Jun-Ya; Matsuda, Kenji","Tuning Transition Electric and Magnetic Dipole Moments: [7]Helicenes Showing Intense Circularly Polarized Luminescence.","The journal of physical chemistry letters","2021","12","1","686","695","10.1021/acs.jpclett.0c03174","","","0.71075","MoKα","","0.0414","0.039","","","0.1092","0.1117","","","","","","1.038","","","","has coordinates","261494","2021-02-04","03:02:30",""
"8000474","6.9687","0.0002","29.4628","0.0009","9.8722","0.0004","90","","96.084","0.001","90","","2015.52","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 N3 O -","- C24 H25 N3 O -","- C96 H100 N12 O4 -","4","1","","Wang, Dan; Xie, Yufeng; Wu, Xinghui; Lei, Yunxiang; Zhou, Yunbing; Cai, Zhengxu; Liu, Miaochang; Wu, Huayue; Huang, Xiaobo; Dong, Yuping","Excitation-Dependent Triplet-Singlet Intensity from Organic Host-Guest Materials: Tunable Color, White-Light Emission, and Room-Temperature Phosphorescence.","The journal of physical chemistry letters","2021","12","7","1814","1821","10.1021/acs.jpclett.1c00188","","","0.71073","MoKα","","0.0653","0.0464","","","0.1146","0.1316","","","","","","1.041","","","","has coordinates","262449","2021-03-04","02:55:53",""
"8000475","17.7928","0.0005","6.5327","0.0002","24.6135","0.0007","90","","98.498","0.001","90","","2829.54","0.14","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H34 N4 O -","- C36 H34 N4 O -","- C144 H136 N16 O4 -","4","1","","Wang, Dan; Xie, Yufeng; Wu, Xinghui; Lei, Yunxiang; Zhou, Yunbing; Cai, Zhengxu; Liu, Miaochang; Wu, Huayue; Huang, Xiaobo; Dong, Yuping","Excitation-Dependent Triplet-Singlet Intensity from Organic Host-Guest Materials: Tunable Color, White-Light Emission, and Room-Temperature Phosphorescence.","The journal of physical chemistry letters","2021","12","7","1814","1821","10.1021/acs.jpclett.1c00188","","","0.71073","MoKα","","0.0691","0.0449","","","0.101","0.1173","","","","","","1.047","","","","has coordinates","262449","2021-03-04","02:55:53",""
"8000476","11.3082","0.0005","24.3551","0.001","11.4415","0.0005","90","","114.665","0.001","90","","2863.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H32 N4 O -","- C36 H32 N4 O -","- C144 H128 N16 O4 -","4","1","","Wang, Dan; Xie, Yufeng; Wu, Xinghui; Lei, Yunxiang; Zhou, Yunbing; Cai, Zhengxu; Liu, Miaochang; Wu, Huayue; Huang, Xiaobo; Dong, Yuping","Excitation-Dependent Triplet-Singlet Intensity from Organic Host-Guest Materials: Tunable Color, White-Light Emission, and Room-Temperature Phosphorescence.","The journal of physical chemistry letters","2021","12","7","1814","1821","10.1021/acs.jpclett.1c00188","","","0.71073","MoKα","","0.0833","0.0512","","","0.1133","0.1317","","","","","","1.048","","","","has coordinates","262449","2021-03-04","02:55:53",""
"8000477","12.6111","0.0005","7.5598","0.0003","15.0851","0.0006","90","","100.886","0.001","90","","1412.29","0.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H32 N4 O -","- C36 H32 N4 O -","- C72 H64 N8 O2 -","2","1","","Wang, Dan; Xie, Yufeng; Wu, Xinghui; Lei, Yunxiang; Zhou, Yunbing; Cai, Zhengxu; Liu, Miaochang; Wu, Huayue; Huang, Xiaobo; Dong, Yuping","Excitation-Dependent Triplet-Singlet Intensity from Organic Host-Guest Materials: Tunable Color, White-Light Emission, and Room-Temperature Phosphorescence.","The journal of physical chemistry letters","2021","12","7","1814","1821","10.1021/acs.jpclett.1c00188","","","0.71073","MoKα","","0.0469","0.0379","","","0.091","0.0981","","","","","","1.053","","","","has coordinates","262449","2021-03-04","02:55:53",""
"8000478","17.1753","0.001","10.1401","0.0006","17.1948","0.001","90","","119.018","0.0013","90","","2618.7","0.3","300","2","300","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H24 Cl6 F N3 O4 Sn -","- C19 H26 Cl6 F N3 O4 Sn -","- C76 H104 Cl24 F4 N12 O16 Sn4 -","4","1","","Su, Binbin; Song, Gaomin; Molokeev, Maxim S.; Golovnev, Nicolay N.; Lesnikov, Maxim K.; Lin, Zheshuai; Xia, Zhiguo","Role of Metal-Chloride Anions in Photoluminescence Regulations for Hybrid Metal Halides.","The journal of physical chemistry letters","2021","12","7","1918","1925","10.1021/acs.jpclett.1c00182","","","0.71073","MoKα","","0.0966","0.0698","","","0.1324","0.1428","","","","","","1.088","","","","has coordinates","262451","2021-03-04","02:56:27",""
"8000479","8.0389","0.001","20.632","0.002","17.359","0.002","90","","101.95","0.002","90","","2816.7","0.6","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Cl6 F N3 O4 Pb2 -","- C19 H26 Cl6 F N3 O4 Pb2 -","- C76 H104 Cl24 F4 N12 O16 Pb8 -","4","1","","Su, Binbin; Song, Gaomin; Molokeev, Maxim S.; Golovnev, Nicolay N.; Lesnikov, Maxim K.; Lin, Zheshuai; Xia, Zhiguo","Role of Metal-Chloride Anions in Photoluminescence Regulations for Hybrid Metal Halides.","The journal of physical chemistry letters","2021","12","7","1918","1925","10.1021/acs.jpclett.1c00182","","","0.71073","MoKα","","0.0713","0.0464","","","0.1066","0.1211","","","","","","1.012","","","","has coordinates","262451","2021-03-04","02:56:30",""
"8000480","7.987","0.003","14.188","0.005","14.544","0.005","70.746","0.008","89.925","0.009","76.317","0.009","1506.5","0.9","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H22 Bi Cl6 F N3 O6 -","- C19 H28 Bi Cl6 F N3 O6 -","- C38 H56 Bi2 Cl12 F2 N6 O12 -","2","1","","Su, Binbin; Song, Gaomin; Molokeev, Maxim S.; Golovnev, Nicolay N.; Lesnikov, Maxim K.; Lin, Zheshuai; Xia, Zhiguo","Role of Metal-Chloride Anions in Photoluminescence Regulations for Hybrid Metal Halides.","The journal of physical chemistry letters","2021","12","7","1918","1925","10.1021/acs.jpclett.1c00182","","","0.71073","MoKα","","0.1163","0.0625","","","0.1503","0.1804","","","","","","0.896","","","","has coordinates","262451","2021-03-04","02:56:32",""
"8000483","18.589","0.004","7.6364","0.0016","13.203","0.003","90","","90","","90","","1874.2","0.7","296","2","296.15","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Bi Cl Cs -","- Bi0.444444 Cl2 Cs0.666667 -","- Bi8 Cl36 Cs12 -","18","2.25","","Tailor, Naveen Kumar; Maity, Partha; Saidaminov, Makhsud I.; Pradhan, Narayan; Satapathi, Soumitra","Dark Self-Healing-Mediated Negative Photoconductivity of a Lead-Free Cs<sub>3</sub>Bi<sub>2</sub>Cl<sub>9</sub> Perovskite Single Crystal.","The journal of physical chemistry letters","2021","12","9","2286","2292","10.1021/acs.jpclett.1c00057","","","0.71073","MoKα","","0.1152","0.0875","","","0.2531","0.2755","","","","","","1.09","","","","has coordinates","263604","2021-04-04","10:03:57",""
"8000484","16.9314","0.0009","11.7303","0.0012","41.194","0.0008","90","","90","","90","","8181.6","1","","","","","","","","","","","","5","P 1","P 1","1","","","","- C H6 Br3 N Pb -","- C10.1674 H60 Br30 N10.1674 Pb17.25 -","- C40.6694 H240 Br120 N40.6694 Pb69 -","4","4","","Wiedemann, Dennis; Breternitz, Joachim; Paley, Daniel W.; Schorr, Susan","Hybrid Perovskite at Full Tilt: Structure and Symmetry Relations of the Incommensurately Modulated Phase of Methylammonium Lead Bromide, MAPbBr<sub>3</sub>.","The journal of physical chemistry letters","2021","12","9","2358","2362","10.1021/acs.jpclett.0c03722","","","","","","","","","","","","","","","","","","","","","has coordinates","263603","2021-04-04","10:03:51",""
"8000485","9.43162","0.00016","11.06107","0.00018","17.6072","0.0003","90","","94.7508","0.0016","90","","1830.54","0.05","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H19 N O -","- C25 H19 N O -","- C100 H76 N4 O4 -","4","1","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","","1.54184","CuKα","","0.0543","0.0449","","","0.1208","0.1296","","","","","","1.039","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000486","9.39192","0.00017","16.751","0.0003","12.0917","0.0002","90","","106.29","0.002","90","","1825.95","0.06","291","2","291","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 N2 -","- C25 H16 N2 -","- C100 H64 N8 -","4","1","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","","1.54184","CuKα","","0.0441","0.0376","","","0.1043","0.1098","","","","","","1.07","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000487","10.2793","0.0002","13.5906","0.0003","13.2253","0.0003","90","","102.19","0.002","90","","1805.94","0.07","291","2","291","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 N2 -","- C25 H16 N2 -","- C100 H64 N8 -","4","1","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","","1.54184","CuKα","","0.0472","0.0388","","","0.1003","0.1072","","","","","","1.033","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000488","31.8745","0.0012","31.8745","0.0012","10.1687","0.0005","90","","90","","120","","8947.1","0.6","290","2","290","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C25 H16 N2 -","- C25 H16 N2 -","- C450 H288 N36 -","18","1","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","","1.54184","CuKα","","0.082","0.0477","","","0.1132","0.128","","","","","","0.979","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000489","20.4508","0.0003","11.98222","0.00013","16.482","0.0002","90","","112.763","0.0016","90","","3724.26","0.09","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H19 N O -","- C25 H19 N O -","- C200 H152 N8 O8 -","8","2","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","x-ray","1.54184","CuKα","","0.0445","0.0377","","","0.1021","0.1086","","","","","","1.02","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000490","11.0496","0.0002","12.7223","0.0002","11.0073","0.0002","90","","99.6402","0.0019","90","","1525.52","0.05","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N2 -","- C20 H14 N2 -","- C80 H56 N8 -","4","1","","Nie, Xiancheng; Su, Hao; Wang, Tao; Miao, Hui; Chen, Biao; Zhang, Guoqing","Aromatic Electrophilic Directing for Fluorescence and Room-Temperature Phosphorescence Modulation.","The journal of physical chemistry letters","2021","12","12","3099","3105","10.1021/acs.jpclett.1c00520","","","1.54184","CuKα","","0.045","0.0391","","","0.1042","0.1134","","","","","","1.055","","","","has coordinates","263605","2021-04-04","10:04:25",""
"8000492","9.9272","0.0003","22.2895","0.0004","10.1168","0.0003","90","","118.872","0.004","90","","1960.32","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 N5 O -","- C23 H21 N5 O -","- C92 H84 N20 O4 -","4","1","","Zhao, Jianjian; Zhang, Peng; Qiao, Hongwei; Hao, Aiyou; Xing, Pengyao","Supramolecular Chirality Suppresses Molecular Chirality: Selective Chiral Recognition in Hierarchically Coassembled Pyridine-Benzimidazole Conjugates with Precise ee% Detection.","The journal of physical chemistry letters","2021","12","11","2912","2921","10.1021/acs.jpclett.1c00548","","x-ray","1.54184","CuKα","","0.0789","0.0697","","","0.1735","0.1805","","","","","","1.052","","","","has coordinates,has disorder","263568","2021-04-04","09:05:53",""
"8000493","3.93525","0.00014","29.2968","0.0011","14.6279","0.0006","90","","95.143","0.003","90","","1679.66","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 N5 O -","- C19 H15 N5 O -","- C76 H60 N20 O4 -","4","1","","Zhao, Jianjian; Zhang, Peng; Qiao, Hongwei; Hao, Aiyou; Xing, Pengyao","Supramolecular Chirality Suppresses Molecular Chirality: Selective Chiral Recognition in Hierarchically Coassembled Pyridine-Benzimidazole Conjugates with Precise ee% Detection.","The journal of physical chemistry letters","2021","12","11","2912","2921","10.1021/acs.jpclett.1c00548","","x-ray","1.54184","CuKα","","0.0968","0.0705","","","0.1882","0.2079","","","","","","1.045","","","","has coordinates,has disorder","263569","2021-04-04","09:06:20",""
"8000494","4.8893","0.001","15.372","0.003","19.518","0.004","67.58","0.03","89.54","0.03","87.55","0.03","1354.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H32 F16 I2 N4 -","- C62 H32 F16 I2 N4 -","- C62 H32 F16 I2 N4 -","1","0.5","","Ding, Zeyang; Shang, Hongxing; Geng, Yijia; Zhang, Shi-Tong; Huo, Zepeng; Yang, Zairan; Li, Bao; Xu, Weiqing; Jiang, Shimei","Tuning Organic Microcrystal Morphologies through Crystal Engineering Strategies toward Anisotropic Optical Waveguide.","The journal of physical chemistry letters","2021","12","19","4585","4592","10.1021/acs.jpclett.1c00769","","","0.71073","MoKα","","0.0584","0.0467","","","0.1426","0.1474","","","","","","1.09","","","","has coordinates,has disorder","265763","2021-06-04","01:04:05",""
"8000495","14.799","0.003","9.962","0.002","15.092","0.003","90","","90.54","0.03","90","","2224.9","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 F6 N2 -","- C28 H16 F6 N2 -","- C112 H64 F24 N8 -","4","1","","Ding, Zeyang; Shang, Hongxing; Geng, Yijia; Zhang, Shi-Tong; Huo, Zepeng; Yang, Zairan; Li, Bao; Xu, Weiqing; Jiang, Shimei","Tuning Organic Microcrystal Morphologies through Crystal Engineering Strategies toward Anisotropic Optical Waveguide.","The journal of physical chemistry letters","2021","12","19","4585","4592","10.1021/acs.jpclett.1c00769","","","0.71073","MoKα","","0.068","0.0553","","","0.1638","0.1737","","","","","","1.092","","","","has coordinates","265763","2021-06-04","01:04:07",""
"8000496","11.5969","0.0005","13.4458","0.0006","15.9778","0.0009","90","","107.103","0.008","90","","2381.2","0.2","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","3,3',6,6'-tetramethoxybianthrone","3,3',6,6'-tetramethoxy-10H,10'H-[9,9'-bianthracenylidene]-10,10'-dione","","- C32 H24 O6 -","- C32 H24 O6 -","- C128 H96 O24 -","4","0.5","","Hamamoto, Yosuke; Hirao, Yasukazu; Kubo, Takashi","Biradicaloid Behavior of a Twisted Double Bond.","The journal of physical chemistry letters","2021","12","19","4729","4734","10.1021/acs.jpclett.1c00664","","","0.71075","MoKα","","0.0533","0.0399","","","0.1003","0.107","","","","","","1.028","","","","has coordinates","265762","2021-06-04","01:03:53",""
"8000497","6.7405","0.0002","38.8619","0.0013","19.7039","0.0007","90","","93.159","0.003","90","","5153.6","0.3","93.15","","93.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3,3',6,6'-tetra-n-octoxybianthrone (Twisted conformer)","3,3',6,6'-tetraoctoxy-10H,10'H-[9,9'-bianthracenylidene]-10,10'-dione","","- C60 H80 O6 -","- C60 H80 O6 -","- C240 H320 O24 -","4","1","","Hamamoto, Yosuke; Hirao, Yasukazu; Kubo, Takashi","Biradicaloid Behavior of a Twisted Double Bond.","The journal of physical chemistry letters","2021","12","19","4729","4734","10.1021/acs.jpclett.1c00664","","x-ray","1.54184","CuKα","","0.1462","0.1102","","","0.3056","0.3269","","","","","","1.034","","","","has coordinates,has disorder","265762","2021-06-04","01:03:55",""
"8000498","8.3262","0.0007","39.247","0.004","8.3629","0.0008","90","","90","","90","","2732.8","0.4","296.8","0.1","296.8","0.1","","","","","","","","5","C c c 2","C 2 -2c","37","","","","- C9 H30 Br7 N3 Pb2 -","- C9 H30 Br7 N3 Pb2 -","- C36 H120 Br28 N12 Pb8 -","4","0.5","","Liang, Mingli; Lin, Weihua; Zhao, Qian; Zou, Xianshao; Lan, Zhenyun; Meng, Jie; Shi, Qi; Castelli, Ivano E.; Canton, Sophie E.; Pullerits, Tönu; Zheng, Kaibo","Free Carriers versus Self-Trapped Excitons at Different Facets of Ruddlesden-Popper Two-Dimensional Lead Halide Perovskite Single Crystals.","The journal of physical chemistry letters","2021","12","20","4965","4971","10.1021/acs.jpclett.1c01148","","","0.71073","MoKα","","0.1222","0.0773","","","0.1915","0.2213","","","","","","1.09","","","","has coordinates","265764","2021-06-04","01:04:17",""
"8000499","8.325","0.0006","42.717","0.004","8.325","0.0008","90","","90","","90","","2960.5","0.5","297.13","0.1","297.13","0.1","","","","","","","","5","C c c 2","C 2 -2c","37","","","","- C11 H37 Br7 N4 Pb2 -","- C11 H37 Br7 N4 Pb2 -","- C44 H148 Br28 N16 Pb8 -","4","0.5","","Liang, Mingli; Lin, Weihua; Zhao, Qian; Zou, Xianshao; Lan, Zhenyun; Meng, Jie; Shi, Qi; Castelli, Ivano E.; Canton, Sophie E.; Pullerits, Tönu; Zheng, Kaibo","Free Carriers versus Self-Trapped Excitons at Different Facets of Ruddlesden-Popper Two-Dimensional Lead Halide Perovskite Single Crystals.","The journal of physical chemistry letters","2021","12","20","4965","4971","10.1021/acs.jpclett.1c01148","","","0.71073","MoKα","","0.1241","0.0633","","","0.1406","0.1707","","","","","","1.045","","","","has coordinates,has disorder","265764","2021-06-04","01:04:19",""
"8000500","39.173","0.004","8.3835","0.0005","8.3225","0.0005","90","","90.789","0.007","90","","2732.9","0.4","296.1","0.2","296.1","0.2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C9 H30 Br7 N3 Pb2 -","- C9 H30 Br7 N3 Pb2 -","- C36 H120 Br28 N12 Pb8 -","4","1","","Liang, Mingli; Lin, Weihua; Zhao, Qian; Zou, Xianshao; Lan, Zhenyun; Meng, Jie; Shi, Qi; Castelli, Ivano E.; Canton, Sophie E.; Pullerits, Tönu; Zheng, Kaibo","Free Carriers versus Self-Trapped Excitons at Different Facets of Ruddlesden-Popper Two-Dimensional Lead Halide Perovskite Single Crystals.","The journal of physical chemistry letters","2021","12","20","4965","4971","10.1021/acs.jpclett.1c01148","","","0.71073","MoKα","","0.1291","0.0882","","","0.2059","0.2557","","","","","","1.018","","","","has coordinates","265764","2021-06-04","01:04:19",""
"8000501","13.826","0.002","17.372","0.005","5.0259","0.001","90","","90","","90","","1207.1","0.5","293","","293","","","","","","","","","4","C m c 21","C 2c -2","36","TON_BNHx","","","- C0.28 N1.68 O24 Si12 -","- C0.28 N1.68 O24 Si12 -","- C0.56 N3.36 O48 Si24 -","2","0.25","","Paliwoda, Damian; Comboni, Davide; Poręba, Tomasz; Hanfland, Michael; Alabarse, Frederico; Maurin, David; Michel, Thierry; Demirci, Umit B.; Rouquette, Jérôme; di Renzo, Francesco; van der Lee, Arie; Bernard, Samuel; Haines, Julien","Anomalous Volume Changes in the Siliceous Zeolite Theta-1 TON due to Hydrogen Insertion under High-Pressure, High-Temperature Conditions.","The journal of physical chemistry letters","2021","12","21","5059","5063","10.1021/acs.jpclett.1c00965","powder diffraction","","0.4957","synchrotron","","","","","","","","","2.7412","","","","","","","","has coordinates","265766","2021-06-04","01:05:42",""
"8000502","15.343","0.004","7.8403","0.0014","10.165","0.003","90","","90","","90","","1222.8","0.5","393","2","393","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H12 Br3 N O Pb -","- C4 H12 Br3 N O Pb -","- C16 H48 Br12 N4 O4 Pb4 -","4","0.5","","Huang, Xue-Qin; Zhang, Hua; Wang, Fang; Gan, Tian; Xu, Zhe-Kun; Wang, Zhong-Xia","A Photoluminescent Lead Bromide Hybrid Perovskite Molecular Ferroelastic Semiconductor with Sequential High-<i>T</i><sub>c</sub> Phase Transitions.","The journal of physical chemistry letters","2021","12","21","5221","5227","10.1021/acs.jpclett.1c01473","","","0.71073","MoKα","","0.2539","0.1143","","","0.2484","0.3099","","","","","","1.165","","","","has coordinates","265767","2021-06-04","01:05:49",""
"8000503","10.3827","0.0007","14.8485","0.0012","7.6353","0.0005","90","","95.432","0.007","90","","1171.83","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br3 N O Pb -","- C4 H12 Br3 N O Pb -","- C16 H48 Br12 N4 O4 Pb4 -","4","1","","Huang, Xue-Qin; Zhang, Hua; Wang, Fang; Gan, Tian; Xu, Zhe-Kun; Wang, Zhong-Xia","A Photoluminescent Lead Bromide Hybrid Perovskite Molecular Ferroelastic Semiconductor with Sequential High-<i>T</i><sub>c</sub> Phase Transitions.","The journal of physical chemistry letters","2021","12","21","5221","5227","10.1021/acs.jpclett.1c01473","","","0.71073","MoKα","","0.087","0.0589","","","0.1507","0.161","","","","","","1.087","","","","has coordinates","265767","2021-06-04","01:05:52",""
"8000504","9.556","0.004","9.556","0.004","7.9","0.002","90","","90","","120","","624.8","0.4","473","2","473","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- C3.2 H8 Br1.2 N0.4 O0.4 Pb0.4 -","- C5.2 Br1.2 Pb0.4 -","- C26 Br6 Pb2 -","5","0.208333","","Huang, Xue-Qin; Zhang, Hua; Wang, Fang; Gan, Tian; Xu, Zhe-Kun; Wang, Zhong-Xia","A Photoluminescent Lead Bromide Hybrid Perovskite Molecular Ferroelastic Semiconductor with Sequential High-<i>T</i><sub>c</sub> Phase Transitions.","The journal of physical chemistry letters","2021","12","21","5221","5227","10.1021/acs.jpclett.1c01473","","","0.71073","MoKα","","0.4816","0.3061","","","0.301","0.3588","","","","","","1.273","","","","has coordinates","265767","2021-06-04","01:05:54",""
"8000505","39.846","0.004","39.846","0.004","39.846","0.004","90","","90","","90","","63264","11","180","2","180","2","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","","","- C24 H8 F2 O5.78 Zr -","- C24 H8 F2 O5.78067 Zr -","- C1152 H384 F96 O277.472 Zr48 -","48","0.25","","Liu, Zhiyu; Wang, Yangyang; Garcia-Garibay, Miguel A","Rotational Dynamics of an Amphidynamic Zirconium Metal-Organic Framework Determined by Dielectric Spectroscopy.","The journal of physical chemistry letters","2021","12","24","5644","5648","10.1021/acs.jpclett.1c01333","","","0.71073","MoKα","","0.0491","0.0333","","","0.0897","0.0971","","","","","","1.2","","","","has coordinates,has disorder","266975","2021-07-04","01:52:00",""
"8000506","39.823","0.003","39.823","0.003","39.823","0.003","90","","90","","90","","63154","8","298","2","298","2","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","","","- C24 H8 F2 O5.58 Zr -","- C24 H8 F2 O5.582 Zr -","- C1152 H384 F96 O267.936 Zr48 -","48","0.25","","Liu, Zhiyu; Wang, Yangyang; Garcia-Garibay, Miguel A","Rotational Dynamics of an Amphidynamic Zirconium Metal-Organic Framework Determined by Dielectric Spectroscopy.","The journal of physical chemistry letters","2021","12","24","5644","5648","10.1021/acs.jpclett.1c01333","","","0.71073","MoKα","","0.062","0.0356","","","0.082","0.0932","","","","","","1.146","","","","has coordinates,has disorder","266975","2021-07-04","01:52:00",""
"8000507","7.2332","0.0004","7.8762","0.0004","8.0903","0.0004","76.673","0.004","83.598","0.004","88.515","0.004","445.7","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","TMPD-PMDA","","- C20 H18 N2 O6 -","- C20 H18 N2 O6 -","- C20 H18 N2 O6 -","1","0.5","","Chen, Wenbin; Sun, Shanshan; Huang, Guanheng; Ni, Shaofei; Xu, Liang; Dang, Li; Phillips, David Lee; Li, Ming-De","Unprecedented Improvement of Near-Infrared Photothermal Conversion Efficiency to 87.2% by Ultrafast Non-radiative Decay of Excited States of Self-Assembly Cocrystal.","The journal of physical chemistry letters","2021","12","24","5796","5801","10.1021/acs.jpclett.1c01021","","x-ray","1.54184","CuKα","","0.0462","0.0438","","","0.1105","0.1137","","","","","","1.095","","","","has coordinates","266974","2021-07-04","01:50:48",""
"8000532","25.2717","0.0016","7.7302","0.0004","12.4159","0.0007","90","","99.618","0.003","90","","2391.4","0.2","101","2","101.2","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Cl6 In Rb3 -","- Cl6 In Rb3 -","- Cl48 In8 Rb24 -","8","1","","Zhang, Chao; Feng, Xuezhen; Song, Qilin; Zhou, Chaocheng; Peng, Lin; Chen, Jing; Liu, Xiaolin; Chen, Hong; Lin, Jia; Chen, Xianfeng","Blue-Violet Emission with Near-Unity Photoluminescence Quantum Yield from Cu(I)-Doped Rb<sub>3</sub>InCl<sub>6</sub> Single Crystals.","The journal of physical chemistry letters","2021","12","33","7928","7934","10.1021/acs.jpclett.1c01751","","","0.71073","MoKα","","0.0247","0.0222","","","0.0499","0.0507","","","","","","1.131","","","","has coordinates","268463","2021-09-04","02:02:15",""
"8000533","21.5256","0.0008","9.7968","0.0004","4.7685","0.0002","90","","90","","90","","1005.59","0.07","113.15","","113.15","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C6 H15 N3 O6 -","- C6 H15 N3 O6 -","- C24 H60 N12 O24 -","4","1","","Guo, Mingxia; Rosbottom, Ian; Zhou, Lina; Yong, Chin W.; Zhou, Ling; Yin, Qiuxiang; Todorov, Ilian T.; Errington, Ethan; Heng, Jerry Y. Y.","Triglycine (GGG) Adopts a Polyproline II (pPII) Conformation in Its Hydrated Crystal Form: Revealing the Role of Water in Peptide Crystallization.","The journal of physical chemistry letters","2021","12","34","8416","8422","10.1021/acs.jpclett.1c01622","","x-ray","0.71073","MoKα","","0.0492","0.0466","","","0.1277","0.1305","","","","","","1.041","","","","has coordinates","268464","2021-09-04","02:03:16",""
"8000534","10.2354","0.0001","13.1008","0.0001","15.8109","0.0002","91.429","0.001","101.553","0.001","103.772","0.001","2011.56","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0242","0.0229","","","0.0608","0.0615","","","","","","1.027","","","","has coordinates","268465","2021-09-04","02:03:40",""
"8000535","30.414","0.0008","4.196","0.0001","14.4536","0.0003","90","","95.248","0.002","90","","1836.8","0.08","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H6 Cu I N3 O0.5 -","- C8 H6 Cu I N3 O0.5 -","- C64 H48 Cu8 I8 N24 O4 -","8","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","0.71073","MoKα","","0.0268","0.0235","","","0.0613","0.0634","","","","","","1.049","","","","has coordinates","268466","2021-09-04","02:04:03",""
"8000536","10.3279","0.0004","13.1429","0.0003","15.9454","0.0002","91.932","0.002","101.499","0.002","103.064","0.002","2059.02","0.1","330","2","330","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0624","0.0418","","","0.0923","0.1233","","","","","","1.142","","","","has coordinates","268467","2021-09-04","02:04:26",""
"8000537","10.253","0.0001","13.107","0.0001","15.8382","0.0001","91.541","0.001","101.537","0.001","103.642","0.001","2020.46","0.03","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0248","0.0232","","","0.0557","0.0564","","","","","","1.051","","","","has coordinates","268468","2021-09-04","02:04:44",""
"8000538","30.414","0.0008","4.196","0.0001","14.4536","0.0003","90","","95.248","0.002","90","","1836.8","0.08","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H6 Cu I N3 O0.5 -","- C8 H6 Cu I N3 O0.5 -","- C64 H48 Cu8 I8 N24 O4 -","8","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","0.71073","MoKα","","0.0208","0.02","","","0.0535","0.0539","","","","","","1.029","","","","has coordinates","268469","2021-09-04","02:05:08",""
"8000539","10.337","0.0006","13.1443","0.0006","15.9625","0.0003","91.989","0.003","101.507","0.004","102.945","0.004","2064.09","0.16","350","2","350","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.1222","0.0808","","","0.1997","0.2633","","","","","","1.156","","","","has coordinates","268470","2021-09-04","02:05:39",""
"8000540","10.2702","0.0001","13.1195","0.0001","15.8628","0.0001","91.637","0.001","101.545","0.001","103.513","0.001","2029.76","0.03","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0267","0.0243","","","0.0582","0.0593","","","","","","1.048","","","","has coordinates","268471","2021-09-04","02:05:59",""
"8000541","10.3022","0.0002","13.1267","0.0002","15.9106","0.0002","91.787","0.001","101.542","0.001","103.293","0.002","2044.93","0.06","270","2","270","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0409","0.034","","","0.0845","0.0918","","","","","","1.116","","","","has coordinates","268472","2021-09-04","02:06:17",""
"8000542","10.2909","0.0001","13.1301","0.0001","15.8935","0.0002","91.716","0.001","101.577","0.001","103.369","0.001","2040.26","0.04","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0299","0.0266","","","0.0618","0.0631","","","","","","1.043","","","","has coordinates","268473","2021-09-04","02:06:36",""
"8000543","10.3155","0.0003","13.136","0.0002","15.932","0.0002","91.851","0.001","101.507","0.002","103.186","0.002","2052.83","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 Cu4 I4 N8 O2 -","- C36 H28 Cu4 I4 N8 O2 -","- C72 H56 Cu8 I8 N16 O4 -","2","1","","Li, Miao; Cheng, Zhiqiang; Wang, Xiaoling; Yu, Zongsu; Zhou, Mingren; Miao, Huixian; Zhaxi, Wenjiang; Huang, Wei; Ma, Xiao; Chen, Qun; Jiang, Shenlong; Zhang, Qun; Wu, Dayu","Negative/Zero Thermal Quenching of Luminescence <i>via</i> Electronic Structural Transition in Copper-Iodide Cluster-Based Coordination Networks.","The journal of physical chemistry letters","2021","12","34","8237","8245","10.1021/acs.jpclett.1c02426","","","1.54178","CuKα","","0.0522","0.0365","","","0.0786","0.1036","","","","","","1.134","","","","has coordinates","268474","2021-09-04","02:06:54",""
"8000544","17.7247","0.001","7.665","0.0004","9.7505","0.0005","90","","90","","90","","1324.7","0.12","","","","","","","","","","","","6","C m c 21","C 2c -2","36","","","","- F4 H2 K2 O12 S3 Zn3 -","- F4 H2 K2 O12 S3 Zn3 -","- F16 H8 K8 O48 S12 Zn12 -","4","0.5","","Zhou, Yang; Zhang, Xingyu; Xiong, Zheyao; Long, Xifa; Li, Yanqiang; Chen, Yangxin; Chen, Xin; Zhao, Sangen; Lin, Zheshuai; Luo, Junhua","Non-π-Conjugated Deep-Ultraviolet Nonlinear Optical Crystal K<sub>2</sub>Zn<sub>3</sub>(SO<sub>4</sub>)(HSO<sub>4</sub>)<sub>2</sub>F<sub>4</sub>.","The journal of physical chemistry letters","2021","12","34","8280","8284","10.1021/acs.jpclett.1c01533","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","268475","2021-09-04","02:07:17",""
"8000545","9.555","0.0001","15.6096","0.0001","32.3131","0.0003","99.959","0.001","91.493","0.001","92.824","0.001","4738.17","0.07","149.99","0.1","149.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C42 H76 Br4 Mn N2 -","- C42 H76 Br4 Mn N2 -","- C168 H304 Br16 Mn4 N8 -","4","2","","Zhang, Shuai; Zhao, Yifei; Zhou, Yayun; Li, Man; Wang, Wei; Ming, Hong; Jing, Xiping; Ye, Shi","Dipole-Orientation-Dependent Förster Resonance Energy Transfer from Aromatic Head Groups to MnBr<sub>4</sub><sup>2-</sup> Blocks in Organic-Inorganic Hybrids.","The journal of physical chemistry letters","2021","12","36","8692","8698","10.1021/acs.jpclett.1c02686","","x-ray","1.54184","CuKα","","0.0518","0.0432","","","0.105","0.1092","","","","","","1.056","","","","has coordinates","269531","2021-10-04","01:43:45",""
"8000546","9.2521","0.0001","17.3068","0.0002","30.8717","0.0003","78.402","0.001","88.41","0.001","76.36","0.001","4704.8","0.09","149.99","0.1","149.99","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C40 H78 Br4 Mn N4 -","- C40 H78 Br4 Mn N4 -","- C160 H312 Br16 Mn4 N16 -","4","2","","Zhang, Shuai; Zhao, Yifei; Zhou, Yayun; Li, Man; Wang, Wei; Ming, Hong; Jing, Xiping; Ye, Shi","Dipole-Orientation-Dependent Förster Resonance Energy Transfer from Aromatic Head Groups to MnBr<sub>4</sub><sup>2-</sup> Blocks in Organic-Inorganic Hybrids.","The journal of physical chemistry letters","2021","12","36","8692","8698","10.1021/acs.jpclett.1c02686","","x-ray","1.54184","CuKα","","0.0485","0.0445","","","0.1251","0.1281","","","","","","1.076","","","","has coordinates","269532","2021-10-04","01:44:10",""
"8000547","8.9169","0.0019","13.042","0.003","17.248","0.004","90","","94.284","0.008","90","","2000.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 F3 I3 N -","- C20 H10 F3 I3 N -","- C80 H40 F12 I12 N4 -","4","1","","Du, Sijia; Ma, Suqian; Xu, Bin; Tian, Wenjing","Optical Waveguide and Photoluminescent Polarization in Organic Cocrystal Polymorphs.","The journal of physical chemistry letters","2021","12","38","9233","9238","10.1021/acs.jpclett.1c02726","","","0.71076","MoKα","","0.051","0.0463","","","0.1227","0.1263","","","","","","1.154","","","","has coordinates","269533","2021-10-04","01:44:42",""
"8000548","5.0705","0.0007","37.539","0.005","10.7938","0.0016","90","","92.192","0.005","90","","2053","0.5","98","2","98","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H10 F3 I3 N -","- C20 H10 F3 I3 N -","- C80 H40 F12 I12 N4 -","4","1","","Du, Sijia; Ma, Suqian; Xu, Bin; Tian, Wenjing","Optical Waveguide and Photoluminescent Polarization in Organic Cocrystal Polymorphs.","The journal of physical chemistry letters","2021","12","38","9233","9238","10.1021/acs.jpclett.1c02726","","","0.71076","MoKα","","0.0723","0.0417","","","0.0824","0.095","","","","","","1.113","","","","has coordinates","269534","2021-10-04","01:45:08",""
"8000549","10.7291","0.0002","12.2843","0.0003","19.3087","0.0004","90","","93.931","0.002","90","","2538.89","0.09","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C70 H50 N4 O4 -","- C70 H50 N4 O4 -","- C140 H100 N8 O8 -","2","1","","Sakamaki, Daisuke; Tanaka, Shunya; Tanaka, Katsuki; Takino, Mayu; Gon, Masayuki; Tanaka, Kazuo; Hirose, Takashi; Hirobe, Daichi; Yamamoto, Hiroshi M.; Fujiwara, Hideki","Double Heterohelicenes Composed of Benzo[<i>b</i>]- and Dibenzo[<i>b</i>,<i>i</i>]phenoxazine: A Comprehensive Comparison of Their Electronic and Chiroptical Properties.","The journal of physical chemistry letters","2021","12","38","9283","9292","10.1021/acs.jpclett.1c02896","","","0.71073","MoKα","","0.0665","0.0452","","","0.1068","0.116","","","","","","1.043","","","","has coordinates","269535","2021-10-04","01:45:36",""
"8000550","8.6191","0.0006","11.0586","0.0009","12.8995","0.0009","96.722","0.007","92.205","0.007","90.967","0.006","1219.88","0.16","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C35 H26 N2 O2 -","- C35 H26 N2 O2 -","- C70 H52 N4 O4 -","2","1","","Sakamaki, Daisuke; Tanaka, Shunya; Tanaka, Katsuki; Takino, Mayu; Gon, Masayuki; Tanaka, Kazuo; Hirose, Takashi; Hirobe, Daichi; Yamamoto, Hiroshi M.; Fujiwara, Hideki","Double Heterohelicenes Composed of Benzo[<i>b</i>]- and Dibenzo[<i>b</i>,<i>i</i>]phenoxazine: A Comprehensive Comparison of Their Electronic and Chiroptical Properties.","The journal of physical chemistry letters","2021","12","38","9283","9292","10.1021/acs.jpclett.1c02896","","","0.71075","MoKα","","0.0692","0.0442","","","0.11","0.1196","","","","","","1.053","","","","has coordinates","269536","2021-10-04","01:46:10",""
"8000558","5.8131","0.00005","15.6887","0.0002","5.2854","0.00008","90","","92.282","0.0006","90","","481.646","0.01","295","","295.03","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","Cs Pb I2 Br","Cs Pb I2 Br","","- Br Cs I2 Pb -","- Br Cs I2 Pb -","- Br2 Cs2 I4 Pb2 -","2","0.5","","Yue, Yaochang; Zhou, Jiyu; Cheng, Qian; Zhang, Xuning; Wang, Boxin; Li, Yanxun; Li, Shilin; Cao, Ruiqi; Wang, Kaiyuan; Wang, Hui; Zhou, Huiqiong; Zhang, Yuan","Peculiar Steric Hindrance Assists Monoclinic Phase Formation toward High-Quality All-Inorganic Perovskites.","The journal of physical chemistry letters","2021","12","45","11228","11237","10.1021/acs.jpclett.1c03021","powder diffraction","","1.5405","CuKα","","","","","","","","","7.3375","1.2232","","","","","","","has coordinates","271114","2021-12-04","03:03:48",""
"8000563","6.6191","0.0002","3.797","0.0001","19.903","0.0005","90","","94.592","0.003","90","","498.61","0.02","170","0.11","170","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 N2 O2 -","- C14 H8 N2 O2 -","- C28 H16 N4 O4 -","2","0.5","","Wang, Long; Cai, Wanlin; Sun, Jing; Wu, Yuling; Zhang, Bin; Tian, Xiangbin; Guo, Shaoting; Liang, WanZhen; Fu, Hongbing; Yao, Jiannian","H-Type-like Aggregation-Accelerated Singlet Fission Process in Dipyrrolonaphthyridinedione Thin Film: The Role of Charge Transfer/Excimer Mixed Intermediate State.","The journal of physical chemistry letters","2021","12","51","12276","12282","10.1021/acs.jpclett.1c03265","","x-ray","1.54184","CuKα","","0.0403","0.037","","","0.0929","0.0951","","","","","","1.117","","","","has coordinates","271788","2022-01-04","02:28:21",""