# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T18:12:41+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 'Chemistry of Materials') AND volume = 27 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
"4002128","6.3964","0.0005","11.0864","0.0009","12.4048","0.001","90","","99.867","0.005","90","","866.65","0.12","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Lithium Tin Sulfide","Lithium Tin Sulfide","","- Li2 S3 Sn -","- Li2 S3 Sn -","- Li16 S24 Sn8 -","8","1","","Brant, Jacilynn A.; Massi, Danielle M.; Holzwarth, N. A. W.; MacNeil, Joseph H.; Douvalis, Alexios P.; Bakas, Thomas; Martin, Steve W.; Gross, Michael D.; Aitken, Jennifer A.","Fast Lithium Ion Conduction in Li2SnS3: Synthesis, Physicochemical Characterization, and Electronic Structure","Chemistry of Materials","2015","27","1","189","","10.1021/cm5037524","","","0.71073","MoKα","","0.0174","0.0131","","","0.0286","0.0302","","","","","","1.056","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002129","9.6012","0.0003","9.6449","0.0003","12.563","0.0004","90","","97.04","0.001","90","","1154.6","0.06","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Mn5 O18 -","- C16 H16 Mn5 O18 -","- C32 H32 Mn10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.034","0.0263","","","0.0645","0.0683","","","","","","1.048","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002130","9.4796","0.0005","9.4223","0.0004","12.4759","0.0006","90","","96.722","0.003","90","","1106.68","0.09","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Fe5 O18 -","- C16 H16 Fe5 O18 -","- C32 H32 Fe10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0646","0.0455","","","0.1127","0.1274","","","","","","1.073","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002131","9.4189","0.0004","9.3268","0.0003","12.3715","0.0005","90","","96.769","0.001","90","","1079.24","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co5 O18 -","- C16 H16 Co5 O18 -","- C32 H32 Co10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0235","0.0203","","","0.0525","0.0538","","","","","","1.089","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002132","9.4427","0.0001","9.3732","0.0001","12.3909","0.0002","90","","96.822","0.001","90","","1088.93","0.02","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co Mn4 O18 -","- C16 H16 Co4.048 Mn0.95 O18 -","- C32 H32 Co8.096 Mn1.9 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0285","0.0217","","","0.0529","0.0556","","","","","","1.012","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002133","9.5092","0.0001","9.4843","0.0001","12.4522","0.0002","90","","96.874","0.001","90","","1114.97","0.02","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co2.5 Mn2.5 O18 -","- C16 H16 Co2.087 Mn2.901 O18 -","- C32 H32 Co4.174 Mn5.802 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0216","0.0188","","","0.0502","0.0515","","","","","","1.114","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002134","9.5376","0.0003","9.5266","0.0003","12.4771","0.0003","90","","96.938","0.001","90","","1125.38","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co1.25 Mn3.75 O18 -","- C16 H16 Co1.873 Mn3.101 O18 -","- C32 H32 Co3.746 Mn6.202 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0301","0.0225","","","0.0572","0.0608","","","","","","1.03","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002135","9.5632","0.0001","9.5665","0.0001","12.5036","0.0001","90","","96.994","0.001","90","","1135.4","0.019","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co1.25 Mn3.75 O18 -","- C16 H16 Co1.28 Mn3.701 O18 -","- C32 H32 Co2.56 Mn7.402 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0335","0.0241","","","0.0598","0.0641","","","","","","1.088","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002136","9.4194","0.0009","9.3271","0.0008","12.3699","0.0011","90","","96.78","0.002","90","","1079.17","0.17","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co4.2 Fe0.8 O18 -","- C16 H16 Co4.19 Fe0.81 O18 -","- C32 H32 Co8.38 Fe1.62 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0386","0.0265","","","0.0602","0.0644","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002137","9.448","0.003","9.368","0.003","12.418","0.004","90","","96.601","0.007","90","","1091.8","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co2.9 Fe2.1 O18 -","- C16 H16 Co2.9 Fe2.1 O18 -","- C32 H32 Co5.8 Fe4.2 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0568","0.0441","","","0.1121","0.1217","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002138","9.4574","0.0004","9.3706","0.0003","12.4237","0.0005","90","","96.7299","0.0009","90","","1093.42","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co2.3 Fe2.7 O18 -","- C16 H16 Co2.3 Fe2.7 O18 -","- C32 H32 Co4.6 Fe5.4 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0348","0.0253","","","0.0582","0.0614","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002139","9.4649","0.0003","9.3881","0.0003","12.4407","0.0004","90","","96.7263","0.0012","90","","1097.84","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co1.5 Fe3.5 O18 -","- C16 H16 Co1.49 Fe3.51 O18 -","- C32 H32 Co2.98 Fe7.02 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0454","0.0292","","","0.0617","0.067","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002140","9.4716","0.0005","9.4045","0.0005","12.4596","0.0006","90","","96.705","0.002","90","","1102.26","0.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Co0.95 Fe4.05 O18 -","- C16 H16 Co0.95 Fe4.07 O18 -","- C32 H32 Co1.9 Fe8.14 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0452","0.0326","","","0.096","0.1018","","","","","","1.165","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002141","9.5048","0.001","9.4721","0.001","12.4969","0.0013","90","","96.884","0.002","90","","1117","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 Fe5 O18 -","- C16 H16 Fe5 O18 -","- C32 H32 Fe10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0413","0.029","","","0.0686","0.0735","","","","","","1.051","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002142","9.5106","0.0018","9.4976","0.0019","12.493","0.002","90","","96.947","0.006","90","","1120.2","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Fe5 O18 -","- C16 H16 Fe5 O18 -","- C32 H32 Fe10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.075","0.0434","","","0.0961","0.109","","","","","","1.03","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002143","9.5471","0.0006","9.5715","0.0006","12.5302","0.0007","90","","97.031","0.002","90","","1136.4","0.12","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Mn5 O18 -","- C16 H16 Mn5 O18 -","- C32 H32 Mn10 O36 -","2","0.5","","Sibille, Romain; Mazet, Thomas; Malaman, Bernard; Wang, Qirong; Didelot, Emilie; François, Michel","Site-Dependent Substitutions in Mixed-Metal Metal‒Organic Frameworks: A Case Study and Guidelines for Analogous Systems","Chemistry of Materials","2015","27","1","133","","10.1021/cm503570f","","","0.71073","MoKα","","0.0474","0.031","","","0.0694","0.076","","","","","","1.005","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002144","10.0421","0.0003","15.3656","0.0004","5.5778","0.0002","90","","90","","90","","860.67","0.05","293","2","293","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- Ca2 Ge Pd2 -","- Ca2 Ge Pd2 -","- Ca16 Ge8 Pd16 -","8","0.5","","Doverbratt, Isa; Ponou, Siméon; Zhang, Yuemei; Lidin, Sven; Miller, Gordon J.","Linear Metal Chains in Ca2M2X (M = Pd, Pt; X = Al, Ge): Origin of the Pairwise Distortion and Its Role in the Structure Stability","Chemistry of Materials","2015","27","1","304","","10.1021/cm503985h","","","0.71073","MoKα","","0.0207","0.0175","","","0.0378","0.0384","","","","","","1.2","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002145","9.6427","0.0003","5.6488","0.0006","7.9236","0.0004","90","","102.13","0.004","90","","421.96","0.05","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ca2 Ge Pt2 -","- Ca2 Ge Pt2 -","- Ca8 Ge4 Pt8 -","4","0.5","","Doverbratt, Isa; Ponou, Siméon; Zhang, Yuemei; Lidin, Sven; Miller, Gordon J.","Linear Metal Chains in Ca2M2X (M = Pd, Pt; X = Al, Ge): Origin of the Pairwise Distortion and Its Role in the Structure Stability","Chemistry of Materials","2015","27","1","304","","10.1021/cm503985h","","","0.71069","MoKα","","0.0464","0.0293","","","0.0556","0.0584","","","","","","0.891","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002146","10.017","0.002","5.7669","0.0012","7.7421","0.0015","90","","102.54","0.03","90","","436.57","0.16","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Al Ca2 Pd2 -","- Al Ca2 Pd2 -","- Al4 Ca8 Pd8 -","4","0.5","","Doverbratt, Isa; Ponou, Siméon; Zhang, Yuemei; Lidin, Sven; Miller, Gordon J.","Linear Metal Chains in Ca2M2X (M = Pd, Pt; X = Al, Ge): Origin of the Pairwise Distortion and Its Role in the Structure Stability","Chemistry of Materials","2015","27","1","304","","10.1021/cm503985h","","","0.71073","MoKα","","0.0209","0.0178","","","0.0408","0.0424","","","","","","1.021","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002147","9.804","0.0008","5.7411","0.0005","7.7307","0.0007","90","","101.889","0.007","90","","425.79","0.06","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Al Ca2 Pt2 -","- Al Ca2 Pt2 -","- Al4 Ca8 Pt8 -","4","0.5","","Doverbratt, Isa; Ponou, Siméon; Zhang, Yuemei; Lidin, Sven; Miller, Gordon J.","Linear Metal Chains in Ca2M2X (M = Pd, Pt; X = Al, Ge): Origin of the Pairwise Distortion and Its Role in the Structure Stability","Chemistry of Materials","2015","27","1","304","","10.1021/cm503985h","","","0.71073","MoKα","","0.0329","0.0296","","","0.0715","0.073","","","","","","1.063","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002148","34.4789","0.0009","29.8973","0.0006","16.2075","0.0004","90","","109.005","0.002","90","","15796.4","0.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H43 N14 O Zn2 -","- C54 H43 N14 O Zn2 -","- C432 H344 N112 O8 Zn16 -","8","1","","Fu, Hong-Ru; Xu, Zhong-Xuan; Zhang, Jian","Water-Stable Metal‒Organic Frameworks for Fast and High Dichromate Trapping via Single-Crystal-to-Single-Crystal Ion Exchange","Chemistry of Materials","2015","27","1","205","","10.1021/cm503767r","","","1.54178","CuKα","","0.0591","0.0464","","","0.1353","0.1441","","","","","","1.056","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002149","28.4095","0.0012","28.0922","0.0011","9.4743","0.0005","90","","90","","90","","7561.3","0.6","100","2","100","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C27 H23 N7 O Zn -","- C27 H23 N7 O Zn -","- C216 H184 N56 O8 Zn8 -","8","1","","Fu, Hong-Ru; Xu, Zhong-Xuan; Zhang, Jian","Water-Stable Metal‒Organic Frameworks for Fast and High Dichromate Trapping via Single-Crystal-to-Single-Crystal Ion Exchange","Chemistry of Materials","2015","27","1","205","","10.1021/cm503767r","","","1.54178","CuKα","","0.1057","0.0805","","","0.2377","0.2657","","","","","","1.003","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002150","35.157","0.008","29.716","0.006","16.278","0.004","90","","109.757","0.004","90","","16005","6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H41 Cr2 N14 O8 Zn2 -","- C54 H41 Cr2 N14 O8 Zn2 -","- C432 H328 Cr16 N112 O64 Zn16 -","8","1","","Fu, Hong-Ru; Xu, Zhong-Xuan; Zhang, Jian","Water-Stable Metal‒Organic Frameworks for Fast and High Dichromate Trapping via Single-Crystal-to-Single-Crystal Ion Exchange","Chemistry of Materials","2015","27","1","205","","10.1021/cm503767r","","","0.71073","MoKα","","0.1286","0.1085","","","0.3157","0.3348","","","","","","1.175","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002151","3.78733","0.00014","3.78733","0.00014","5.5144","0.0003","90","","90","","90","","79.098","0.006","295","","295","","","","","","","","","2","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- Fe0.91 Se -","- Fe0.91 Se -","- Fe1.82 Se2 -","2","0.125","","Greenfield, Joshua T.; Kamali, Saeed; Lee, Kathleen; Kovnir, Kirill","A Solution for Solution-Produced β-FeSe: Elucidating and Overcoming Factors that Prevent Superconductivity","Chemistry of Materials","2015","27","2","588","","10.1021/cm5041612","powder diffraction","x-ray","0.413734","","","0.0699","0.0716","","0.0668","0.0666","","","","0.97","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002152","3.77354","0.00005","3.77354","0.00005","5.52226","0.00012","90","","90","","90","","78.635","0.002","295","","295","","","","","","","","","2","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- Fe Se -","- Fe0.996 Se -","- Fe1.992 Se2 -","2","0.125","","Greenfield, Joshua T.; Kamali, Saeed; Lee, Kathleen; Kovnir, Kirill","A Solution for Solution-Produced β-FeSe: Elucidating and Overcoming Factors that Prevent Superconductivity","Chemistry of Materials","2015","27","2","588","","10.1021/cm5041612","powder diffraction","x-ray","0.41373","","","0.0542","0.0538","","0.045","0.0448","","","","0.94","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002153","3.78372","0.00013","3.78372","0.00013","5.512","0.0003","90","","90","","90","","78.913","0.006","293","","293","","","","","","","","","2","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- Fe0.925 Se -","- Fe0.926 Se -","- Fe1.852 Se2 -","2","0.125","","Greenfield, Joshua T.; Kamali, Saeed; Lee, Kathleen; Kovnir, Kirill","A Solution for Solution-Produced β-FeSe: Elucidating and Overcoming Factors that Prevent Superconductivity","Chemistry of Materials","2015","27","2","588","","10.1021/cm5041612","powder diffraction","x-ray","0.413685","","","0.0663","0.0651","","0.0605","0.0603","","","","0.99","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002154","3.77233","0.00004","3.77233","0.00004","5.52249","0.0001","90","","90","","90","","78.5876","0.0018","293","","293","","","","","","","","","2","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- Fe Se -","- Fe1.001 Se -","- Fe2.002 Se2 -","2","0.125","","Greenfield, Joshua T.; Kamali, Saeed; Lee, Kathleen; Kovnir, Kirill","A Solution for Solution-Produced β-FeSe: Elucidating and Overcoming Factors that Prevent Superconductivity","Chemistry of Materials","2015","27","2","588","","10.1021/cm5041612","powder diffraction","x-ray","0.413685","","","0.0481","0.0472","","0.0455","0.0455","","","","1","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002155","7.188","0.005","23.171","0.019","7.044","0.005","90","","116.25","0.03","90","","1052.2","1.4","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Ga2 Pb Se6 Si -","- Ga2 Pb Se6 Si -","- Ga8 Pb4 Se24 Si4 -","4","1","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Cui, Hong-Hua; Zhang, Wei-Long; Zhang, Hao; Chen, Hong; He, Zhang-Zhen; Cheng, Wen-Dan","PbGa2MSe6(M = Si, Ge): Two Exceptional Infrared Nonlinear Optical Crystals","Chemistry of Materials","2015","27","3","914","","10.1021/cm504195x","","","0.71073","MoKα","","0.0503","0.0368","","","0.0774","0.1209","","","","","","0.962","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4002156","47.135","0.016","7.578","0.003","12.161","0.004","90","","90","","90","","4344","3","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- Ga2 Ge Pb Se6 -","- Ga2 Ge Pb Se6 -","- Ga32 Ge16 Pb16 Se96 -","16","1","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Cui, Hong-Hua; Zhang, Wei-Long; Zhang, Hao; Chen, Hong; He, Zhang-Zhen; Cheng, Wen-Dan","PbGa2MSe6(M = Si, Ge): Two Exceptional Infrared Nonlinear Optical Crystals","Chemistry of Materials","2015","27","3","914","","10.1021/cm504195x","","","0.71073","MoKα","","0.0315","0.0269","","","0.0492","0.0507","","","","","","0.946","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4002162","7.2931","0.0015","15.612","0.003","13.557","0.003","90","","106.64","0.03","90","","1479","0.6","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- K Nb2 P Se10 -","- K Nb2 P Se10 -","- K4 Nb8 P4 Se40 -","4","2","","Syrigos, Jonathan C.; Clark, Daniel J.; Saouma, Felix O.; Clarke, Samantha M.; Fang, Lei; Jang, Joon I.; Kanatzidis, Mercouri G.","Semiconducting Properties and Phase-Matching Nonlinear Optical Response of the One-Dimensional Selenophosphates ANb2PSe10(A = K, Rb, and Cs)","Chemistry of Materials","2015","27","1","255","","10.1021/cm5038217","","","0.71073","MoKα","","0.0728","0.0571","","","0.1307","0.1386","","","","","","1.063","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002163","7.381","0.0015","7.8359","0.0016","13.564","0.003","90","","106.75","0.03","90","","751.2","0.3","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- Nb2 P Rb Se10 -","- Nb2 P Rb Se10 -","- Nb4 P2 Rb2 Se20 -","2","1","","Syrigos, Jonathan C.; Clark, Daniel J.; Saouma, Felix O.; Clarke, Samantha M.; Fang, Lei; Jang, Joon I.; Kanatzidis, Mercouri G.","Semiconducting Properties and Phase-Matching Nonlinear Optical Response of the One-Dimensional Selenophosphates ANb2PSe10(A = K, Rb, and Cs)","Chemistry of Materials","2015","27","1","255","","10.1021/cm5038217","","","0.71073","MoKα","","0.06","0.0461","","","0.1067","0.1239","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002164","14.6257","0.0007","7.8097","0.0004","13.5533","0.0006","90","","98.557","0.004","90","","1530.86","0.13","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- Cs Nb2 P Se10 -","- Cs Nb2 P Se10 -","- Cs4 Nb8 P4 Se40 -","4","2","","Syrigos, Jonathan C.; Clark, Daniel J.; Saouma, Felix O.; Clarke, Samantha M.; Fang, Lei; Jang, Joon I.; Kanatzidis, Mercouri G.","Semiconducting Properties and Phase-Matching Nonlinear Optical Response of the One-Dimensional Selenophosphates ANb2PSe10(A = K, Rb, and Cs)","Chemistry of Materials","2015","27","1","255","","10.1021/cm5038217","","","0.71073","MoKα","","0.082","0.0577","","","0.1108","0.1214","","","","","","1.085","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002165","6.2778","0.0013","11.601","0.002","14.431","0.003","90","","90","","90","","1051","0.4","293","","293","","","","","","","","synthesis as described","3","I b a m","-I 2 2c","72","","","","- Cs2 Hg3 S4 -","- Cs2 Hg3 S4 -","- Cs8 Hg12 S16 -","4","0.25","","Islam, Saiful M.; Vanishri, S.; Li, Hao; Stoumpos, Constantinos C.; Peters, John. A.; Sebastian, Maria; Liu, Zhifu; Wang, Shichao; Haynes, Alyssa S.; Im, Jino; Freeman, Arthur J.; Wessels, Bruce; Kanatzidis, Mercouri G.","Cs2Hg3S4: A Low-Dimensional Direct Bandgap Semiconductor","Chemistry of Materials","2015","27","1","370","","10.1021/cm504089r","","x-ray","0.71073","MoKα","","0.0512","0.0403","","","0.0825","0.0892","","","","","","1.064","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002166","16.693","0.002","16.693","0.002","22.577","0.005","90","","90","","90","","6291.2","1.8","90","2","90","2","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","","","","- Ca14 Mg Sb11 -","- Ca14 Mg Sb10.908 -","- Ca112 Mg8 Sb87.264 -","8","0.25","","Hu, Yufei; Wang, Jian; Kawamura, Airi; Kovnir, Kirill; Kauzlarich, Susan M.","Yb14MgSb11and Ca14MgSb11—New Mg-Containing Zintl Compounds and Their Structures, Bonding, and Thermoelectric Properties","Chemistry of Materials","2015","27","1","343","","10.1021/cm504059t","","","0.71073","MoKα","","0.0792","0.0394","","","0.0752","0.0907","","","","","","1.006","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002167","16.625","0.009","16.625","0.009","22.24","0.02","90","","90","","90","","6147","7","90","2","90","2","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","","","","- Mg Sb11 Yb14 -","- Mg Sb11 Yb14 -","- Mg8 Sb88 Yb112 -","8","0.25","","Hu, Yufei; Wang, Jian; Kawamura, Airi; Kovnir, Kirill; Kauzlarich, Susan M.","Yb14MgSb11and Ca14MgSb11—New Mg-Containing Zintl Compounds and Their Structures, Bonding, and Thermoelectric Properties","Chemistry of Materials","2015","27","1","343","","10.1021/cm504059t","","","0.71073","MoKα","","0.0256","0.0194","","","0.0381","0.0398","","","","","","1.143","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002168","10.8196","0.0008","7.2809","0.0004","11.326","0.0009","90","","107.695","0.008","90","","850.01","0.11","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Al B4 H18 N -","- Al B4 H18 N -","- Al4 B16 H72 N4 -","4","1","","Dovgaliuk, Iurii; Le Duff, Cécile S.; Robeyns, Koen; Devillers, Michel; Filinchuk, Yaroslav","Mild Dehydrogenation of Ammonia Borane Complexed with Aluminum Borohydride","Chemistry of Materials","2015","27","3","768","","10.1021/cm503601h","","","0.71073","MoKα","","0.0895","0.0645","","","0.1618","0.1801","","","","","","1.06","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002169","7.8585","0.0002","6.86473","0.00014","15.7136","0.0008","90","","96.429","0.004","90","","842.36","0.05","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Al B4 H18 N -","- Al B4 H18 N -","- Al4 B16 H72 N4 -","4","1","","Dovgaliuk, Iurii; Le Duff, Cécile S.; Robeyns, Koen; Devillers, Michel; Filinchuk, Yaroslav","Mild Dehydrogenation of Ammonia Borane Complexed with Aluminum Borohydride","Chemistry of Materials","2015","27","3","768","","10.1021/cm503601h","","","0.82103","synchrotron","","0.0301","0.028","","","0.0768","0.078","","","","","","1.082","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002171","8.2365","0.0003","12.1468","0.0005","24.7923","0.0011","90","","90","","90","","2480.4","0.18","175","","175","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H36 B2 Mg O16 -","- C14 H36 B2 Mg O16 -","- C56 H144 B8 Mg4 O64 -","4","0.5","","Sene, Saad; Bégu, Sylvie; Gervais, Christel; Renaudin, Guillaume; Mesbah, Adel; Smith, Mark E.; Mutin, P. Hubert; van der Lee, Arie; Nedelec, Jean-Marie; Bonhomme, Christian; Laurencin, Danielle","Intercalation of Benzoxaborolate Anions in Layered Double Hydroxides: Toward Hybrid Formulations for Benzoxaborole Drugs","Chemistry of Materials","2015","27","4","1242","","10.1021/cm504181w","","","0.71073","MoKα","","0.0481","0.0362","","0.0874","0.0821","0.0874","","","","","","1.007","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002172","10.4309","0.0003","14.533","0.0004","16.1153","0.0005","98.105","0.003","98.045","0.002","101.478","0.002","2334.38","0.12","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H52 B6 Ca3 O20 -","- C42 H52 B6 Ca3 O20 -","- C84 H104 B12 Ca6 O40 -","2","1","","Sene, Saad; Bégu, Sylvie; Gervais, Christel; Renaudin, Guillaume; Mesbah, Adel; Smith, Mark E.; Mutin, P. Hubert; van der Lee, Arie; Nedelec, Jean-Marie; Bonhomme, Christian; Laurencin, Danielle","Intercalation of Benzoxaborolate Anions in Layered Double Hydroxides: Toward Hybrid Formulations for Benzoxaborole Drugs","Chemistry of Materials","2015","27","4","1242","","10.1021/cm504181w","","","0.71073","MoKα","","0.0699","0.0513","","","0.119","0.1217","","","","","","1.832","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002173","11.233986","0.000014","30.92293","0.00004","8.6602","0.000013","90","","135.414","0.00006","90","","2111.87","0.005","290","","290","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H60 B4 Mg2 O26 -","- C28 H60 B4 Mg2 O26 -","- C56 H120 B8 Mg4 O52 -","2","0.5","","Sene, Saad; Bégu, Sylvie; Gervais, Christel; Renaudin, Guillaume; Mesbah, Adel; Smith, Mark E.; Mutin, P. Hubert; van der Lee, Arie; Nedelec, Jean-Marie; Bonhomme, Christian; Laurencin, Danielle","Intercalation of Benzoxaborolate Anions in Layered Double Hydroxides: Toward Hybrid Formulations for Benzoxaborole Drugs","Chemistry of Materials","2015","27","4","1242","","10.1021/cm504181w","powder diffraction","","0.999942","synchrotron","","","","","","","","","5.6949","1.47","","","","","","","has coordinates","189197","2020-10-21","18:00:00",""
"4002175","10.8672","0.0011","3.1543","0.0003","6.35","0.0006","90","","90","","90","","217.67","0.04","296","2","296","2","","","","","","","","3","P m m a","-P 2a 2a","51","","","","- B3 Nb3 Ru3 -","- B3 Nb3 Ru3 -","- B6 Nb6 Ru6 -","2","0.25","","Xie, Weiwei; Luo, Huixia; Baroudi, Kristen; Krizan, Jason W.; Phelan, Brendan F.; Cava, Robert J.","Fragment-Based Design of NbRuB as a New Metal-Rich Boride Superconductor","Chemistry of Materials","2015","27","4","1149","","10.1021/cm504449s","","","0.71073","MoKα","","0.0135","0.0115","","","0.0199","0.0203","","","","","","1.141","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002176","31.5176","0.0003","31.5176","0.0003","31.5176","0.0003","90","","90","","90","","31308.3","0.5","130","2","130","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C57 H57 N6 O23 Tb4 -","- C57 H57.01 N6 O23 Tb4 -","- C912 H912.16 N96 O368 Tb64 -","16","0.333333","","Li, Hai-Yang; Wei, Yong-Li; Dong, Xi-Yan; Zang, Shuang-Quan; Mak, Thomas C. W.","Novel Tb-MOF Embedded with Viologen Species for Multi-Photofunctionality: Photochromism, Photomodulated Fluorescence, and Luminescent pH Sensing","Chemistry of Materials","2015","27","4","1327","","10.1021/cm504350q","","","0.71073","MoKα","","0.0471","0.0459","","","0.1248","0.1257","","","","","","1.095","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002177","14.7432","0.0002","14.7432","0.0002","14.7432","0.0002","90","","90","","90","","3204.61","0.08","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ag0.28 Ba0.5 S1.33 Sn0.33 -","- Ag0.28425 Ba0.5 S1.33333 Sn0.333333 -","- Ag13.644 Ba24 S64 Sn16 -","48","1","","Lai, Wei-Han; Haynes, Alyssa S.; Frazer, Laszlo; Chang, Yu-Ming; Liu, Te-Kun; Lin, Jyun-Fan; Liang, I-Chu; Sheu, Hwo-Shuenn; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang","Second Harmonic Generation Response Optimized at Various Optical Wavelength Ranges through a Series of Cubic Chalcogenides Ba6Ag2.67+4δSn4.33−δS16‒xSex","Chemistry of Materials","2015","27","4","1316","","10.1021/cm504348z","","","0.71073","MoKα","","0.0188","0.0185","","","0.0411","0.0413","","","","","","1.133","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002178","14.7422","0.0007","14.7422","0.0007","14.7422","0.0007","90","","90","","90","","3204","0.3","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ag0.33 Ba0.5 S1.33 Sn0.33 -","- Ag0.32875 Ba0.5 S1.33333 Sn0.333333 -","- Ag15.78 Ba24 S64 Sn16 -","48","1","","Lai, Wei-Han; Haynes, Alyssa S.; Frazer, Laszlo; Chang, Yu-Ming; Liu, Te-Kun; Lin, Jyun-Fan; Liang, I-Chu; Sheu, Hwo-Shuenn; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang","Second Harmonic Generation Response Optimized at Various Optical Wavelength Ranges through a Series of Cubic Chalcogenides Ba6Ag2.67+4δSn4.33−δS16‒xSex","Chemistry of Materials","2015","27","4","1316","","10.1021/cm504348z","","","0.71073","MoKα","","0.0215","0.0215","","","0.0571","0.0571","","","","","","1.11","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002179","14.7482","0.0003","14.7482","0.0003","14.7482","0.0003","90","","90","","90","","3207.87","0.11","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ag0.33 Ba0.5 S1.33 Sn0.33 -","- Ag0.33275 Ba0.5 S1.33333 Sn0.333333 -","- Ag15.972 Ba24 S64 Sn16 -","48","1","","Lai, Wei-Han; Haynes, Alyssa S.; Frazer, Laszlo; Chang, Yu-Ming; Liu, Te-Kun; Lin, Jyun-Fan; Liang, I-Chu; Sheu, Hwo-Shuenn; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang","Second Harmonic Generation Response Optimized at Various Optical Wavelength Ranges through a Series of Cubic Chalcogenides Ba6Ag2.67+4δSn4.33−δS16‒xSex","Chemistry of Materials","2015","27","4","1316","","10.1021/cm504348z","","","0.71073","MoKα","","0.024","0.0239","","","0.0642","0.0643","","","","","","1.115","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002180","14.9596","0.0002","14.9596","0.0002","14.9596","0.0002","90","","90","","90","","3347.8","0.08","296","2","296","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- Ag0.31 Ba0.5 S0.79 Se0.54 Sn0.33 -","- Ag0.3065 Ba0.5 S0.794333 Se0.539 Sn0.333333 -","- Ag14.712 Ba24 S38.128 Se25.872 Sn16 -","48","1","","Lai, Wei-Han; Haynes, Alyssa S.; Frazer, Laszlo; Chang, Yu-Ming; Liu, Te-Kun; Lin, Jyun-Fan; Liang, I-Chu; Sheu, Hwo-Shuenn; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang","Second Harmonic Generation Response Optimized at Various Optical Wavelength Ranges through a Series of Cubic Chalcogenides Ba6Ag2.67+4δSn4.33−δS16‒xSex","Chemistry of Materials","2015","27","4","1316","","10.1021/cm504348z","","","0.71073","MoKα","","0.0202","0.0202","","","0.052","0.052","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002181","15.2983","0.0003","15.2983","0.0003","15.2983","0.0003","90","","90","","90","","3580.38","0.12","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ag0.31 Ba0.5 Se1.33 Sn0.33 -","- Ag0.3105 Ba0.5 Se1.33333 Sn0.333333 -","- Ag14.904 Ba24 Se64 Sn16 -","48","1","","Lai, Wei-Han; Haynes, Alyssa S.; Frazer, Laszlo; Chang, Yu-Ming; Liu, Te-Kun; Lin, Jyun-Fan; Liang, I-Chu; Sheu, Hwo-Shuenn; Ketterson, John B.; Kanatzidis, Mercouri G.; Hsu, Kuei-Fang","Second Harmonic Generation Response Optimized at Various Optical Wavelength Ranges through a Series of Cubic Chalcogenides Ba6Ag2.67+4δSn4.33−δS16‒xSex","Chemistry of Materials","2015","27","4","1316","","10.1021/cm504348z","","","0.71073","MoKα","","0.0276","0.0266","","","0.0664","0.0672","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002182","9.5475","0.0003","9.5475","0.0003","7.1019","0.0005","90","","90","","120","","560.64","0.05","100","","100","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Nd8 O26 Si6 Sr2 -","- Nd8 O26 Si6 Sr2 -","- Nd8 O26 Si6 Sr2 -","1","0.0833333","","An, Tao; Baikie, Tom; Weyland, Matthew; Shin, J. Felix; Slater, Peter R.; Wei, Jun; White, Tim J.","Crystal Chemical Analysis of Nd9.33Si6O26and Nd8Sr2Si6O26Apatite Electrolytes Using Aberration-Corrected Scanning Transmission Electron Microscopy and Impedance Spectroscopy","Chemistry of Materials","2015","27","4","1217","","10.1021/cm504009d","","x-ray","0.71069","MoKα","","0.031","0.0304","","","0.0477","0.0479","","","","3.29","3.29","3.29","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002183","32.985","0.007","8.9901","0.0019","34.432","0.007","90","","115.591","0.002","90","","9209","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H43 La N4 O10 -","- C36 H43 La N4 O10 -","- C288 H344 La8 N32 O80 -","8","1","","Wang, Chao; Li, Liangjun; Bell, Jon G.; Lv, Xiaoxia; Tang, Sifu; Zhao, Xuebo; Thomas, K. Mark","Hysteretic Gas and Vapor Sorption in Flexible Interpenetrated Lanthanide-Based Metal‒Organic Frameworks with Coordinated Molecular Gating via Reversible Single-Crystal-to-Single-Crystal Transformation for Enhanced Selectivity","Chemistry of Materials","2015","27","5","1502","","10.1021/cm503533r","","","0.71073","MoKα","","0.072","0.0554","","","0.148","0.1546","","","","","","1.127","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002184","32.84","0.03","8.998","0.008","34.21","0.03","90","","115.564","0.011","90","","9119","14","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H43 N4 O10 Sm -","- C36 H43 N4 O10 Sm -","- C288 H344 N32 O80 Sm8 -","8","1","","Wang, Chao; Li, Liangjun; Bell, Jon G.; Lv, Xiaoxia; Tang, Sifu; Zhao, Xuebo; Thomas, K. Mark","Hysteretic Gas and Vapor Sorption in Flexible Interpenetrated Lanthanide-Based Metal‒Organic Frameworks with Coordinated Molecular Gating via Reversible Single-Crystal-to-Single-Crystal Transformation for Enhanced Selectivity","Chemistry of Materials","2015","27","5","1502","","10.1021/cm503533r","","","0.71073","MoKα","","0.1228","0.0639","","","0.1432","0.1713","","","","","","1.049","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002185","32.14","0.02","9.156","0.006","26.864","0.018","90","","112.859","0.007","90","","7285","8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H43 N4 O10 Sm -","- C36 H43 N4 O10 Sm -","- C288 H344 N32 O80 Sm8 -","8","1","","Wang, Chao; Li, Liangjun; Bell, Jon G.; Lv, Xiaoxia; Tang, Sifu; Zhao, Xuebo; Thomas, K. Mark","Hysteretic Gas and Vapor Sorption in Flexible Interpenetrated Lanthanide-Based Metal‒Organic Frameworks with Coordinated Molecular Gating via Reversible Single-Crystal-to-Single-Crystal Transformation for Enhanced Selectivity","Chemistry of Materials","2015","27","5","1502","","10.1021/cm503533r","","","0.71073","MoKα","","0.1113","0.0625","","","0.1434","0.1565","","","","","","1.051","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002186","32.599","0.005","8.8449","0.0014","34.246","0.008","90","","116.457","0.002","90","","8840","3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H43 N4 O10 Sm -","- C36 H43 N4 O10 Sm -","- C288 H344 N32 O80 Sm8 -","8","1","","Wang, Chao; Li, Liangjun; Bell, Jon G.; Lv, Xiaoxia; Tang, Sifu; Zhao, Xuebo; Thomas, K. Mark","Hysteretic Gas and Vapor Sorption in Flexible Interpenetrated Lanthanide-Based Metal‒Organic Frameworks with Coordinated Molecular Gating via Reversible Single-Crystal-to-Single-Crystal Transformation for Enhanced Selectivity","Chemistry of Materials","2015","27","5","1502","","10.1021/cm503533r","","","0.71073","MoKα","","0.0887","0.0507","","","0.0929","0.0991","","","","","","1.048","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002187","13.362","0.004","20.179","0.006","20.186","0.007","76.11","0.04","72.33","0.03","72.24","0.03","4873","3","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C48 Cr6 K2 Mo12 N6 O66 P -","- C48 Cr6 K1.998 Mo12 N6 O66 P -","- C96 Cr12 K3.996 Mo24 N12 O132 P2 -","2","1","","Kawahara, Ryosuke; Uchida, Sayaka; Mizuno, Noritaka","Redox-Induced Reversible Uptake‒Release of Cations in Porous Ionic Crystals Based on Polyoxometalate: Cooperative Migration of Electrons with Alkali Metal Ions","Chemistry of Materials","2015","27","6","2092","","10.1021/cm504526z","","","0.7107","MoKα","","","0.1164","","","","0.3477","","","","","","1.043","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002188","29.59","0.06","25.19","0.05","13.39","0.02","90","","91.23","0.04","90","","9978","3","93","","93","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 Cr6 Mo12 N6 O66 P -","- C48 Cr6 Mo12 N6 O66 P -","- C192 Cr24 Mo48 N24 O264 P4 -","4","1","","Kawahara, Ryosuke; Uchida, Sayaka; Mizuno, Noritaka","Redox-Induced Reversible Uptake‒Release of Cations in Porous Ionic Crystals Based on Polyoxometalate: Cooperative Migration of Electrons with Alkali Metal Ions","Chemistry of Materials","2015","27","6","2092","","10.1021/cm504526z","","","0.7107","MoKα","","","0.166","","","","0.4461","","","","","","1.092","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002189","13.527","0.008","20.304","0.013","20.367","0.012","75.84","0.03","72.18","0.03","72.14","0.03","4998","5","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C48 Cr6 K Mo12 N6 O66 P -","- C48 Cr6 K Mo12 N6 O66 P -","- C96 Cr12 K2 Mo24 N12 O132 P2 -","2","1","","Kawahara, Ryosuke; Uchida, Sayaka; Mizuno, Noritaka","Redox-Induced Reversible Uptake‒Release of Cations in Porous Ionic Crystals Based on Polyoxometalate: Cooperative Migration of Electrons with Alkali Metal Ions","Chemistry of Materials","2015","27","6","2092","","10.1021/cm504526z","","","0.7107","MoKα","","","0.2332","","","","0.5534","","","","","","1.784","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002190","8.954","0.002","8.954","0.002","8.954","0.002","90","","90","","90","","717.9","0.3","299","2","299","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ge13 Ir4 Y3 -","- Ge13 Ir4 Y3 -","- Ge26 Ir8 Y6 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0343","0.0321","","","0.0861","0.0879","","","","","","1.245","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002191","8.939","0.001","8.939","0.001","8.939","0.001","90","","90","","90","","714.28","0.14","298","2","298","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ge12.53 Lu3 Os4 -","- Ge12.54 Lu3 Os4 -","- Ge25.08 Lu6 Os8 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0347","0.0333","","","0.0784","0.0789","","","","","","1.257","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002192","8.8659","0.0007","8.8659","0.0005","8.8659","0.0005","90","","90","","90","","696.9","0.08","298","2","298","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ge13 Lu3 Rh4 -","- Ge13 Lu3 Rh4 -","- Ge26 Lu6 Rh8 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0378","0.0289","","","0.0571","0.059","","","","","","1.13","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002193","8.923","0.002","8.923","0.002","8.923","0.002","90","","90","","90","","710.4","0.3","299","2","299","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ge12.93 Rh4 Y3 -","- Ge12.93 Rh4 Y3 -","- Ge25.86 Rh8 Y6 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0419","0.0393","","","0.0971","0.099","","","","","","1.116","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002194","8.9933","0.0009","8.9933","0.0009","8.9933","0.0009","90","","90","","90","","727.37","0.13","298","2","298","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ge12.65 Os4 Y3 -","- Ge12.66 Os4 Y3 -","- Ge25.32 Os8 Y6 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0345","0.0261","","","0.0563","0.0651","","","","","","1.163","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002195","8.6997","0.0006","8.6997","0.0006","8.6997","0.0006","90","","90","","90","","658.43","0.08","298","2","298","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Co4 Ge13 Lu3 -","- Co4 Ge13 Lu3 -","- Co8 Ge26 Lu6 -","2","0.0416667","","Rai, Binod K.; Oswald, Iain W. H.; Wang, Jiakui K.; McCandless, Gregory T.; Chan, Julia Y.; Morosan, E.","Superconductivity in Single Crystals of Lu3T4Ge13‒x(T= Co, Rh, Os) and Y3T4Ge13‒x(T= Ir, Rh, Os)","Chemistry of Materials","2015","27","7","2488","","10.1021/cm504658h","","","0.71073","MoKα","","0.0326","0.0305","","","0.0713","0.0718","","","","","","1.257","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002196","10.427","0.0003","10.427","0.0003","10.427","0.0003","90","","90","","90","","1133.65","0.06","200","2","200","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ga8.3 K8 Si37.3 -","- Ga8.42 K8 Si37.58 -","- Ga8.42 K8 Si37.58 -","1","0.0208333","","Sui, Fan; He, Hua; Bobev, Svilen; Zhao, Jing; Osterloh, Frank E.; Kauzlarich, Susan M.","Synthesis, Structure, Thermoelectric Properties, and Band Gaps of Alkali Metal Containing Type I Clathrates: A8Ga8Si38(A = K, Rb, Cs) and K8Al8Si38","Chemistry of Materials","2015","27","8","2812","","10.1021/cm504436v","","","0.71073","MoKα","","0.0203","0.0155","","","0.0371","0.0384","","","","","","1.088","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002197","10.5339","0.0003","10.5339","0.0003","10.5339","0.0003","90","","90","","90","","1168.87","0.06","200","2","200","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Cs8 Ga7.8 Si38.2 -","- Cs8 Ga7.764 Si38.236 -","- Cs8 Ga7.764 Si38.236 -","1","0.0208333","","Sui, Fan; He, Hua; Bobev, Svilen; Zhao, Jing; Osterloh, Frank E.; Kauzlarich, Susan M.","Synthesis, Structure, Thermoelectric Properties, and Band Gaps of Alkali Metal Containing Type I Clathrates: A8Ga8Si38(A = K, Rb, Cs) and K8Al8Si38","Chemistry of Materials","2015","27","8","2812","","10.1021/cm504436v","","","0.71073","MoKα","","0.0149","0.0127","","","0.0298","0.03","","","","","","1.183","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002198","10.4433","0.0015","10.4433","0.0015","10.4433","0.0015","90","","90","","90","","1139","0.3","200","2","200","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ga7.5 Rb8 Si38.5 -","- Ga7.456 Rb8 Si38.544 -","- Ga7.456 Rb8 Si38.544 -","1","0.0208333","","Sui, Fan; He, Hua; Bobev, Svilen; Zhao, Jing; Osterloh, Frank E.; Kauzlarich, Susan M.","Synthesis, Structure, Thermoelectric Properties, and Band Gaps of Alkali Metal Containing Type I Clathrates: A8Ga8Si38(A = K, Rb, Cs) and K8Al8Si38","Chemistry of Materials","2015","27","8","2812","","10.1021/cm504436v","","","0.71073","MoKα","","0.0371","0.0228","","","0.0435","0.0459","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002200","21.1713","0.0016","11.8611","0.0007","17.0191","0.0014","90","","113.864","0.004","90","","3908.4","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","La(hfac)3(pyDTDA)2","","","- C27 H11 F18 La N6 O6 S4 -","- C27 H11 F18 La N6 O6 S4 -","- C108 H44 F72 La4 N24 O24 S16 -","4","0.5","","Fatila, Elisabeth M.; Mayo, R. Alex; Rouzières, Mathieu; Jennings, Michael C.; Dechambenoit, Pierre; Soldatov, Dmitriy V.; Mathonière, Corine; Clérac, Rodolphe; Coulon, Claude; Preuss, Kathryn E.","Radical‒Radical Recognition: Switchable Magnetic Properties and Re-entrant Behavior","Chemistry of Materials","2015","27","11","4023","","10.1021/acs.chemmater.5b00967","","","0.71073","MoKα","","0.0269","0.0238","","","0.0587","0.0608","","","","","","1.076","","","","has coordinates","140081","2020-10-21","18:00:00",""
"4002201","12.027","0.0006","12.1954","0.0006","16.7873","0.0008","91.392","0.002","108.334","0.002","118.531","0.002","2007.96","0.18","220","2","220","2","","","","","","","","7","P -1","-P 1","2","La(hfac)3(pyDTDA)2","","","- C27 H11 F18 La N6 O6 S4 -","- C27 H11 F18 La N6 O6 S4 -","- C54 H22 F36 La2 N12 O12 S8 -","2","1","","Fatila, Elisabeth M.; Mayo, R. Alex; Rouzières, Mathieu; Jennings, Michael C.; Dechambenoit, Pierre; Soldatov, Dmitriy V.; Mathonière, Corine; Clérac, Rodolphe; Coulon, Claude; Preuss, Kathryn E.","Radical‒Radical Recognition: Switchable Magnetic Properties and Re-entrant Behavior","Chemistry of Materials","2015","27","11","4023","","10.1021/acs.chemmater.5b00967","","","0.71073","MoKα","","0.0658","0.0567","","","0.1469","0.1553","","","","","","1.059","","","","has coordinates","140081","2020-10-21","18:00:00",""
"4002202","21.6251","0.0039","12.1226","0.0025","17.5034","0.0054","90","","116.012","0.006","90","","4123.7","1.7","340","2","340","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","La(hfac)3(pyDTDA)2","","","- C27 H11 F18 La N6 O6 S4 -","- C27 H11 F18 La N6 O6 S4 -","- C108 H44 F72 La4 N24 O24 S16 -","4","0.5","","Fatila, Elisabeth M.; Mayo, R. Alex; Rouzières, Mathieu; Jennings, Michael C.; Dechambenoit, Pierre; Soldatov, Dmitriy V.; Mathonière, Corine; Clérac, Rodolphe; Coulon, Claude; Preuss, Kathryn E.","Radical‒Radical Recognition: Switchable Magnetic Properties and Re-entrant Behavior","Chemistry of Materials","2015","27","11","4023","","10.1021/acs.chemmater.5b00967","","","0.71073","MoKα","","0.0499","0.0408","","","0.1096","0.1174","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002203","8.357","0.002","5.95","0.001","19.356","0.003","90","","97.453","0.005","90","","954.3","0.3","300","","300","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H20 S2 -","- C24 H20 S2 -","- C48 H40 S4 -","2","1","","Inoue, Satoru; Minemawari, Hiromi; Tsutsumi, Jun’ya; Chikamatsu, Masayuki; Yamada, Toshikazu; Horiuchi, Sachio; Tanaka, Mutsuo; Kumai, Reiji; Yoneya, Makoto; Hasegawa, Tatsuo","Effects of Substituted Alkyl Chain Length on Solution-Processable Layered Organic Semiconductor Crystals","Chemistry of Materials","2015","27","11","3809","","10.1021/acs.chemmater.5b00810","","","0.71075","MoKα","","0.0671","0.0486","","","0.1001","0.1148","","","","","","1.073","","","","has coordinates","140080","2020-10-21","18:00:00",""
"4002204","6.0866","0.0001","7.8111","0.0001","42.5972","0.0007","90","","91.8394","0.0007","90","","2024.16","0.05","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C25 H22 S2 -","- C25 H22 S2 -","- C100 H88 S8 -","4","1","","Inoue, Satoru; Minemawari, Hiromi; Tsutsumi, Jun’ya; Chikamatsu, Masayuki; Yamada, Toshikazu; Horiuchi, Sachio; Tanaka, Mutsuo; Kumai, Reiji; Yoneya, Makoto; Hasegawa, Tatsuo","Effects of Substituted Alkyl Chain Length on Solution-Processable Layered Organic Semiconductor Crystals","Chemistry of Materials","2015","27","11","3809","","10.1021/acs.chemmater.5b00810","","","1.54187","CuKα","","0.1132","0.0691","","","0.1837","0.2272","","","","","","1.016","","","","has coordinates","140080","2020-10-21","18:00:00",""
"4002205","5.9541","0.0001","38.9909","0.0001","15.7295","0.0007","90","","90.0471","0.0007","90","","3651.69","0.17","300","","300","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 S2 -","- C23 H18 S2 -","- C184 H144 S16 -","8","2","","Inoue, Satoru; Minemawari, Hiromi; Tsutsumi, Jun’ya; Chikamatsu, Masayuki; Yamada, Toshikazu; Horiuchi, Sachio; Tanaka, Mutsuo; Kumai, Reiji; Yoneya, Makoto; Hasegawa, Tatsuo","Effects of Substituted Alkyl Chain Length on Solution-Processable Layered Organic Semiconductor Crystals","Chemistry of Materials","2015","27","11","3809","","10.1021/acs.chemmater.5b00810","","","1.54187","CuKα","","0.1119","0.0874","","","0.2305","0.2508","","","","","","1.036","","","","has coordinates","140080","2020-10-21","18:00:00",""
"4002206","6.0957","0.0001","7.8022","0.0001","44.243","0.003","90","","93.5107","0.0007","90","","2100.24","0.15","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C26 H24 S2 -","- C26 H24 S2 -","- C104 H96 S8 -","4","1","","Inoue, Satoru; Minemawari, Hiromi; Tsutsumi, Jun’ya; Chikamatsu, Masayuki; Yamada, Toshikazu; Horiuchi, Sachio; Tanaka, Mutsuo; Kumai, Reiji; Yoneya, Makoto; Hasegawa, Tatsuo","Effects of Substituted Alkyl Chain Length on Solution-Processable Layered Organic Semiconductor Crystals","Chemistry of Materials","2015","27","11","3809","","10.1021/acs.chemmater.5b00810","","","1.5527","synchrotron","","0.1177","0.0756","","","0.2075","0.2299","","","","","","0.916","","","","has coordinates","140080","2020-10-21","18:00:00",""
"4002207","6.0861","0.0002","7.804","0.0003","49.128","0.001","90","","97.199","0.001","90","","2314.99","0.13","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C28 H28 S2 -","- C28 H28 S2 -","- C112 H112 S8 -","4","1","","Inoue, Satoru; Minemawari, Hiromi; Tsutsumi, Jun’ya; Chikamatsu, Masayuki; Yamada, Toshikazu; Horiuchi, Sachio; Tanaka, Mutsuo; Kumai, Reiji; Yoneya, Makoto; Hasegawa, Tatsuo","Effects of Substituted Alkyl Chain Length on Solution-Processable Layered Organic Semiconductor Crystals","Chemistry of Materials","2015","27","11","3809","","10.1021/acs.chemmater.5b00810","","","1.5528","synchrotron","","0.0839","0.0771","","","0.2264","0.244","","","","","","1.15","","","","has coordinates","140080","2020-10-21","18:00:00",""
"4002208","23.976","0.008","23.976","","23.976","","90","","90","","90","","13783","5","110","","110","","","","","","","","","4","P -4 3 m","P -4 2 3","215","","","","- C240 Cd54 O4 S80 -","- C252 Cd54 O4 S80 -","- C252 Cd54 O4 S80 -","1","0.0416667","","Levchenko, Tetyana I.; Kübel, Christian; Wang, Di; Khalili Najafabadi, Bahareh; Huang, Yining; Corrigan, John F.","Controlled Solvothermal Routes to Hierarchical 3D Superparticles of Nanoscopic CdS","Chemistry of Materials","2015","27","10","3666","","10.1021/acs.chemmater.5b00586","","","0.71073","MoKα","","0.114","0.0752","","","0.2368","0.3065","","","","","","1.08","","","","has coordinates,has disorder","137845","2020-10-21","18:00:00",""
"4002209","32.116","0.002","4.6371","0.0003","12.3564","0.0008","90","","109.822","0.001","90","","1731.15","0.19","89","2","89","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Europium Cadmium/Zinc Antimonide","","- Cd1.65 Eu11 Sb12 Zn4.35 -","- Cd1.678 Eu11 Sb12 Zn4.322 -","- Cd3.356 Eu22 Sb24 Zn8.644 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Sui, Fan; Ohno, Saneyuki; Zevalkink, Alexandra; Snyder, Jeffrey G.; Kauzlarich, Susan M.","High Temperature Thermoelectric Properties of the Solid-Solution Zintl Phase Eu11Cd6‒xZnxSb12","Chemistry of Materials","2015","27","12","4413","","10.1021/acs.chemmater.5b01301","","","0.71073","MoKα","","0.0569","0.0329","","","0.0571","0.0631","","","","","","0.991","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002210","32.4248","0.0015","4.7079","0.0002","12.4035","0.0006","90","","109.917","0.001","90","","1780.18","0.14","89","2","89","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Europium Cadmium/Zinc Antimonide","","- Cd5.06 Eu11 Sb12 Zn0.94 -","- Cd5.05 Eu11 Sb12 Zn0.95 -","- Cd10.1 Eu22 Sb24 Zn1.9 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Sui, Fan; Ohno, Saneyuki; Zevalkink, Alexandra; Snyder, Jeffrey G.; Kauzlarich, Susan M.","High Temperature Thermoelectric Properties of the Solid-Solution Zintl Phase Eu11Cd6‒xZnxSb12","Chemistry of Materials","2015","27","12","4413","","10.1021/acs.chemmater.5b01301","","","0.71073","MoKα","","0.0186","0.0176","","","0.0361","0.0364","","","","","","1.243","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002211","32.3927","0.0014","4.7025","0.0002","12.3961","0.0006","90","","109.891","0.001","90","","1775.61","0.14","89","2","89","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Europium Cadmium/Zinc Antimonide","","- Cd4.74 Eu11 Sb12 Zn1.25 -","- Cd4.742 Eu11 Sb12 Zn1.258 -","- Cd9.484 Eu22 Sb24 Zn2.516 -","2","0.25","","Kazem, Nasrin; Hurtado, Antonio; Sui, Fan; Ohno, Saneyuki; Zevalkink, Alexandra; Snyder, Jeffrey G.; Kauzlarich, Susan M.","High Temperature Thermoelectric Properties of the Solid-Solution Zintl Phase Eu11Cd6‒xZnxSb12","Chemistry of Materials","2015","27","12","4413","","10.1021/acs.chemmater.5b01301","","","0.71073","MoKα","","0.0208","0.0189","","","0.0361","0.0367","","","","","","1.16","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002212","7.916","0.0007","6.7366","0.0003","9.078","0.0008","90","","90.737","0.007","90","","484.06","0.06","293","","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C3 H3 N3 O3 -","- C3 H3 N3 O3 -","- C12 H12 N12 O12 -","4","0.5","","Söllradl, Stefan; Greiwe, Magnus; Bukas, Vanessa J.; Buchner, Magnus R.; Widenmeyer, Marc; Kandemir, Timur; Zweifel, Tobias; Senyshyn, Anatoliy; Günther, Sebastian; Nilges, Tom; Türler, Andreas; Niewa, Rainer","Nitrogen-Doping in ZnO via Combustion Synthesis?","Chemistry of Materials","2015","27","12","4188","","10.1021/cm504200q","","x-ray","0.71073","MoKα","","0.0539","0.0313","","","0.0777","0.079","","","","2.18","2.18","1.64","","","","has coordinates","288070","2023-12-06","12:50:29",""
"4002213","10.8754","0.0005","10.8754","0.0005","5.6042","0.0003","90","","90","","90","","662.83","0.06","100","2","100","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Hf5 Ru0.46 Sb2.54 -","- Hf5 Ru0.46 Sb2.54 -","- Hf20 Ru1.84 Sb10.16 -","4","0.125","","Xie, Weiwei; Luo, Huixia; Seibel, Elizabeth M.; Nielsen, Morten B.; Cava, Robert J.","Superconductivity in Hf5Sb3‒xRux: Are Ru and Sb a Critical Charge-Transfer Pair for Superconductivity?","Chemistry of Materials","2015","27","13","4511","","10.1021/acs.chemmater.5b01655","","","0.71073","MoKα","","0.017","0.016","","","0.0388","0.0391","","","","","","1.153","","","","has coordinates","154593","2020-10-21","18:00:00",""
"4002214","11.5276","0.0003","12.9749","0.0004","7.0126","0.0002","90","","105.584","0.0014","90","","1010.31","0.05","300","","300","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- C26 H14 N4 -","- C26 H14 N4 -","- C52 H28 N8 -","2","0.25","","Yokokura, Seiya; Takahashi, Yukihiro; Nonaka, Hiroki; Hasegawa, Hiroyuki; Harada, Jun; Inabe, Tamotsu; Kumai, Reiji; Okamoto, Hiroshi; Matsushita, Michio M.; Awaga, Kunio","Switching of Transfer Characteristics of an Organic Field-Effect Transistor by Phase Transitions: Sensitive Response to Molecular Dynamics and Charge Fluctuation","Chemistry of Materials","2015","27","12","4441","","10.1021/acs.chemmater.5b01383","","","0.71073","MoKα","","0.0564","0.0452","","","0.1317","0.1477","","","","","","1.069","","","","has coordinates,has disorder","139984","2020-10-21","18:00:00",""
"4002215","11.573","0.0015","12.8479","0.0016","6.9092","0.0009","90","","107.053","0.002","90","","982.2","0.2","155","","155","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C26 H14 N4 -","- C26 H14 N4 -","- C52 H28 N8 -","2","0.5","","Yokokura, Seiya; Takahashi, Yukihiro; Nonaka, Hiroki; Hasegawa, Hiroyuki; Harada, Jun; Inabe, Tamotsu; Kumai, Reiji; Okamoto, Hiroshi; Matsushita, Michio M.; Awaga, Kunio","Switching of Transfer Characteristics of an Organic Field-Effect Transistor by Phase Transitions: Sensitive Response to Molecular Dynamics and Charge Fluctuation","Chemistry of Materials","2015","27","12","4441","","10.1021/acs.chemmater.5b01383","","","0.71073","MoKα","","0.0552","0.0413","","","0.1217","0.1331","","","","","","1.094","","","","has coordinates,has disorder","139985","2020-10-21","18:00:00",""
"4002216","11.37","0.003","12.818","0.003","6.918","0.0017","90.884","0.004","107.171","0.004","94.998","0.004","958.7","0.4","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C26 H14 N4 -","- C26 H14 N4 -","- C52 H28 N8 -","2","1","","Yokokura, Seiya; Takahashi, Yukihiro; Nonaka, Hiroki; Hasegawa, Hiroyuki; Harada, Jun; Inabe, Tamotsu; Kumai, Reiji; Okamoto, Hiroshi; Matsushita, Michio M.; Awaga, Kunio","Switching of Transfer Characteristics of an Organic Field-Effect Transistor by Phase Transitions: Sensitive Response to Molecular Dynamics and Charge Fluctuation","Chemistry of Materials","2015","27","12","4441","","10.1021/acs.chemmater.5b01383","","","0.71073","MoKα","","0.0551","0.0449","","","0.1124","0.1174","","","","","","1.061","","","","has coordinates","139986","2020-10-21","18:00:00",""
"4002217","3.93936","0.00001","3.93936","0.00001","3.93936","0.00001","90","","90","","90","","61.1332","0.0003","298","","298","","","","","","","","","4","P m -3 m","-P 4 2 3","221","lead cobalt rhenium oxide","","","- Cr0.5 O3 Pb Re0.5 -","- Cr0.495 O3 Pb Re0.505 -","- Cr0.495 O3 Pb Re0.505 -","1","0.0208333","","Retuerto, Maria; Li, Man-Rong; Stephens, Peter W.; Sánchez-Benítez, Javier; Deng, Xiaoyu; Kotliar, Gabriel; Croft, Mark C.; Ignatov, Alexander; Walker, David; Greenblatt, Martha","Half-Metallicity in Pb2CoReO6Double Perovskite and High Magnetic Ordering Temperature in Pb2CrReO6Perovskite","Chemistry of Materials","2015","27","12","4450","","10.1021/acs.chemmater.5b01442","powder diffraction","","0.70018","","","","","","","","","","0.014","4.23","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002218","5.1928","0.0002","9.5598","0.0004","18.9575","0.0008","90","","90","","90","","941.09","0.07","90","2","90","2","","","","","","","","3","F d d d","-F 2uv 2vw","70","","","","- Ni2 P4 Sr -","- Ni2 P4 Sr -","- Ni16 P32 Sr8 -","8","","","Dolyniuk, Juli-Anna; Wang, Jian; Lee, Kathleen; Kovnir, Kirill","Twisted Kelvin Cells and Truncated Octahedral Cages in the Crystal Structures of Unconventional Clathrates, AM2P4(A = Sr, Ba; M = Cu, Ni)","Chemistry of Materials","2015","27","12","4476","","10.1021/acs.chemmater.5b01592","","","0.71073","MoKα","","0.0099","0.0099","","","0.0264","0.0265","","","","","","1.224","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002450","6.6353","0.0003","7.1464","0.0004","13.7788","0.0007","79.537","0.005","84.127","0.004","62.494","0.005","569.75","0.06","120","0.1","120","","","","","","","","","5","P -1","-P 1","2","","","","- C3 H12 B10 O2 S -","- C3 H12 B10 O2 S -","- C6 H24 B20 O4 S2 -","2","1","","Thomas, John C.; Boldog, Ishtvan; Auluck, Harsharn S.; Bereciartua, Pablo J.; Dušek, Michal; Macháček, Jan; Bastl, Zdeněk; Weiss, Paul S.; Baše, Tomáš","Self-Assembledp-Carborane Analogue ofp-Mercaptobenzoic Acid on Au{111}","Chemistry of Materials","2015","27","15","5425","","10.1021/acs.chemmater.5b02263","","x-ray","1.54184","CuKα","","0.0687","0.0418","","","0.0929","0.1067","","","","1.54","1.54","1.48","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002451","9.5736","0.0002","9.49","0.0002","13.1739","0.0003","90","","90","","90","","1196.89","0.04","298","","","","","","","","","","","4","P n a 21","P 2c -2n","33","Zirconium Magnesium Molybdate","","","- Mg Mo3 O12 Zr -","- Mg Mo3 O12 Zr -","- Mg4 Mo12 O48 Zr4 -","4","1","","Romao, Carl P.; Perras, Frédéric A.; Werner-Zwanziger, Ulrike; Lussier, Joey A.; Miller, Kimberly J.; Calahoo, Courtney M.; Zwanziger, Josef W.; Bieringer, Mario; Marinkovic, Bojan A.; Bryce, David L.; White, Mary Anne","Zero Thermal Expansion in ZrMgMo3O12: NMR Crystallography Reveals Origins of Thermoelastic Properties","Chemistry of Materials","2015","27","7","2633","2646","10.1021/acs.chemmater.5b00429","","x-ray","1.5406","CuKα~1~,Kα~2~","K-L~2,3~","","","","","","","","","","","","","","","","has coordinates","152692","2020-10-21","18:00:00",""
"4003148","44.271","0.002","44.271","0.002","44.271","0.002","90","","90","","90","","86768","7","228","2","228","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","MTAF-2","","","- C30 H12 Cu6 N9 O23.5 -","- C30 H12 Cu6 N9 O23.5 -","- C960 H384 Cu192 N288 O752 -","32","0.166667","","Gao, Wen-Yang; Cai, Rong; Pham, Tony; Forrest, Katherine A.; Hogan, Adam; Nugent, Patrick; Williams, Kia; Wojtas, Lukasz; Luebke, Ryan; Weseliński, Łukasz J.; Zaworotko, Michael J.; Space, Brian; Chen, Yu-Sheng; Eddaoudi, Mohamed; Shi, Xiaodong; Ma, Shengqian","Remote Stabilization of Copper Paddlewheel Based Molecular Building Blocks in Metal‒Organic Frameworks","Chemistry of Materials","2015","27","6","2144","","10.1021/acs.chemmater.5b00084","","","0.41328","synchrotron","","0.1083","0.0911","","","0.2572","0.2757","","","","","","1.079","","","","has coordinates,has disorder","231389","2020-10-21","18:00:00",""
"4003149","44.588","0.003","44.588","0.003","44.588","0.003","90","","90","","90","","88645","10","100","2","100","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","MPAF-1","","","- C33 H15 Cu6 N6 O19 -","- C33 H15 Cu6 N6 O19 -","- C1056 H480 Cu192 N192 O608 -","32","0.166667","","Gao, Wen-Yang; Cai, Rong; Pham, Tony; Forrest, Katherine A.; Hogan, Adam; Nugent, Patrick; Williams, Kia; Wojtas, Lukasz; Luebke, Ryan; Weseliński, Łukasz J.; Zaworotko, Michael J.; Space, Brian; Chen, Yu-Sheng; Eddaoudi, Mohamed; Shi, Xiaodong; Ma, Shengqian","Remote Stabilization of Copper Paddlewheel Based Molecular Building Blocks in Metal‒Organic Frameworks","Chemistry of Materials","2015","27","6","2144","","10.1021/acs.chemmater.5b00084","","","0.41328","synchrotron","","0.0751","0.0674","","","0.2084","0.2133","","","","","","1.08","","","","has coordinates,has disorder","231390","2020-10-21","18:00:00",""
"4003150","12.9801","0.0015","15.4628","0.0018","17.708","0.002","93.992","0.002","90.777","0.002","94.773","0.002","3532.6","0.7","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C71 H56.2 Cu3 F9 N8 O15.1 S3 -","- C71 H56.2 Cu3 F9 N8 O15.1 S3 -","- C142 H112.4 Cu6 F18 N16 O30.2 S6 -","2","1","","Ma, Jian-Ping; Wang, Shen-Qing; Zhao, Chao-Wei; Yu, Yang; Dong, Yu-Bin","Cu(II)-Metal‒Organic Framework with Open Coordination Metal Sites for Low Temperature Thermochemical Water Oxidation","Chemistry of Materials","2015","27","11","3805","","10.1021/acs.chemmater.5b00754","","","0.71073","MoKα","","0.0855","0.0559","","","0.1429","0.1618","","","","","","1.032","","","","has coordinates,has disorder","231391","2020-10-21","18:00:00",""
"4003151","13.0883","0.0004","13.0883","0.0004","26.7939","0.001","90","","90","","90","","4589.9","0.3","100","0.2","100","0.2","","","","","","","","7","P 42 2 2","P 4c 2","93","","","","- C35 H26 Cu F3 N4 O6 S -","- C35 H26 Cu F3 N4 O6 S -","- C140 H104 Cu4 F12 N16 O24 S4 -","4","0.5","","Ma, Jian-Ping; Wang, Shen-Qing; Zhao, Chao-Wei; Yu, Yang; Dong, Yu-Bin","Cu(II)-Metal‒Organic Framework with Open Coordination Metal Sites for Low Temperature Thermochemical Water Oxidation","Chemistry of Materials","2015","27","11","3805","","10.1021/acs.chemmater.5b00754","","","0.7107","MoKα","","0.1029","0.0777","","","0.2273","0.2473","","","","","","1.076","","","","has coordinates","231392","2020-10-21","18:00:00",""
"4003152","5.839","0.002","6.39","0.003","15.961","0.007","90","","98.826","0.006","90","","588.5","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H7 Cl Li N O -","- C3 H7 Cl Li N O -","- C12 H28 Cl4 Li4 N4 O4 -","4","1","","Chinnam, Parameswara R.; Clymer, Rebecca N.; Jalil, Abdel Aziz; Wunder, Stephanie L.; Zdilla, Michael J.","Bulk-Phase Ion Conduction in Cocrystalline LiCl·N,N-Dimethylformamide: A New Paradigm for Solid Electrolytes Based upon the Pearson Hard‒Soft Acid‒Base Concept","Chemistry of Materials","2015","27","16","5479","","10.1021/acs.chemmater.5b00940","","","0.71073","MoKα","","0.1076","0.0539","","","0.1082","0.1243","","","","","","1.009","","","","has coordinates","231393","2020-10-21","18:00:00",""
"4003153","19.594","0.01","8.739","0.004","18.853","0.01","90","","99.234","0.009","90","","3186","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H17 N4 O2 P -","- C16 H17 N4 O2 P -","- C128 H136 N32 O16 P8 -","8","1","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.0395","0.032","","","0.0809","0.0854","","","","","","1.052","","","","has coordinates","231394","2020-10-21","18:00:00",""
"4003154","23.781","0.005","23.781","0.005","11.844","0.003","90","","90","","90","","6698","3","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C32 H30 Cu N10 O8 P2 -","- C32 H30 Cu N10 O8 P2 -","- C256 H240 Cu8 N80 O64 P16 -","8","0.5","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.0912","0.0436","","","0.085","0.1003","","","","","","1.005","","","","has coordinates","231395","2020-10-21","18:00:00",""
"4003155","25.688","0.005","12.212","0.003","17.076","0.007","90","","127.862","0.003","90","","4229","2","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C33 H41 Cu N10 O12.5 P2 -","- C33 H33 Cu N10 O12.5 P2 -","- C132 H132 Cu4 N40 O50 P8 -","4","1","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.2004","0.1103","","","0.2813","0.3448","","","","","","1.044","","","","has coordinates,has disorder","231396","2020-10-21","18:00:00",""
"4003156","8.433","0.003","9.174","0.004","10.074","0.004","80.921","0.007","80.814","0.007","89.836","0.008","759.5","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 N4 O P -","- C16 H15 N4 O P -","- C32 H30 N8 O2 P2 -","2","1","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.0426","0.0383","","","0.1037","0.1072","","","","","","1.058","","","","has coordinates","231397","2020-10-21","18:00:00",""
"4003157","25.688","0.005","12.212","0.003","17.076","0.007","90","","127.862","0.003","90","","4229","2","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C32 H34 Cu N10 O10 P2 -","- C32 H30 Cu N10 O10 P2 -","- C128 H120 Cu4 N40 O40 P8 -","4","1","","Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy","Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly","Chemistry of Materials","2015","27","15","5222","","10.1021/acs.chemmater.5b01267","","","0.71073","MoKα","","0.1609","0.0992","","","0.2592","0.298","","","","","","0.894","","","","has coordinates,has disorder","231398","2020-10-21","18:00:00",""
"4003158","6.128","0.0015","7.5805","0.0019","28.009","0.007","90","","94.509","0.007","90","","1297.1","0.6","100","2","100","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C38 H20 S4 -","- C38 H20 S4 -","- C76 H40 S8 -","2","0.5","","Abe, Masahiro; Mori, Takamichi; Osaka, Itaru; Sugimoto, Kunihisa; Takimiya, Kazuo","Thermally, Operationally, and Environmentally Stable Organic Thin-Film Transistors Based on Bis[1]benzothieno[2,3-d:2′,3′-d′]naphtho[2,3-b:6,7-b′]dithiophene Derivatives: Effective Synthesis, Electronic Structures, and Structure‒Property Relationship","Chemistry of Materials","2015","27","14","5049","","10.1021/acs.chemmater.5b01608","","","0.6997","synchrotron","","0.1377","0.0803","","","0.1875","0.2287","","","","","","1.182","","","","has coordinates","231399","2020-10-21","18:00:00",""
"4003159","28.32","0.005","28.32","0.005","12.835","0.003","90","","90","","120","","8915","3","298","","298","","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C26 H15 La N O18.39 -","- C26.0001 H14.0001 La N0.9999 O18.3928 -","- C234.001 H126.001 La9 N8.9991 O165.535 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","powder diffraction","","0.827107","Synchrotron","","","","","","","","","0.0097","1.065","","","","","","","has coordinates","231400","2020-10-21","18:00:00",""
"4003160","24.1843","0.0005","24.1843","0.0005","13.0217","0.0005","90","","90","","120","","6595.8","0.3","298","2","298","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.0608","0.0432","","","0.0797","0.0842","","","","","","1.004","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003161","24.2009","0.0007","24.2009","0.0007","12.9648","0.0006","90","","90","","120","","6576","0.4","100","2","100","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H14 La N O9 -","- C21 H14 La N O9 -","- C189 H126 La9 N9 O81 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.0578","0.0472","","","0.0979","0.1022","","","","","","1.047","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003162","24.197","0.0006","24.197","0.0006","13.1426","0.0004","90","","90","","120","","6664","0.3","323","2","323","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.0582","0.0445","","","0.0928","0.0985","","","","","","1.022","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003163","24.2447","0.0008","24.2447","0.0008","13.1705","0.0008","90","","90","","120","","6704.5","0.5","373","2","373","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.073","0.0479","","","0.1069","0.1166","","","","","","0.976","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003164","24.2372","0.0012","24.2372","0.0012","13.2135","0.0011","90","","90","","120","","6722.2","0.7","423","2","423","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.1015","0.0591","","","0.0851","0.094","","","","","","0.979","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003165","24.313","0.002","24.313","0.002","13.184","0.002","90","","90","","120","","6749.2","1.3","473","2","473","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.1352","0.0695","","","0.1387","0.1554","","","","","","1.026","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003166","24.25","0.009","24.25","0.009","13.093","0.012","90","","90","","120","","6668","7","500","2","500","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O6 -","- C21 H12 La N O6 -","- C189 H108 La9 N9 O54 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.2265","0.0833","","","0.1168","0.1382","","","","","","0.916","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003167","24.1719","0.0012","24.1719","0.0012","13.011","0.0012","90","","90","","120","","6583.6","0.8","298","2","298","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 La N O7 -","- C21 H12 La N O7 -","- C189 H108 La9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.0911","0.0648","","","0.1059","0.1148","","","","","","0.99","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003168","24.188","0.0009","24.188","0.0009","13.1489","0.0011","90","","90","","120","","6662.2","0.7","298","2","298","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C21 H12 Ce N O7 -","- C21 H12 Ce N O7 -","- C189 H108 Ce9 N9 O63 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","","","0.71073","MoKα","","0.0668","0.0513","","","0.1102","0.1179","","","","","","1.036","","","","has coordinates","231401","2020-10-21","18:00:00",""
"4003169","35.242","0.0019","35.242","0.0019","13.493","0.005","90","","90","","120","","14513","5","298","","298","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","","","- C33 H15 Eu O20.9 -","- C33 H15 Eu O20.9098 -","- C297 H135 Eu9 O188.188 -","9","0.5","","Yao, Qingxia; Bermejo Gómez, Antonio; Su, Jie; Pascanu, Vlad; Yun, Yifeng; Zheng, Haoquan; Chen, Hong; Liu, Leifeng; Abdelhamid, Hani Nasser; Martín-Matute, Belén; Zou, Xiaodong","Series of Highly Stable Isoreticular Lanthanide Metal‒Organic Frameworks with Expanding Pore Size and Tunable Luminescent Properties","Chemistry of Materials","2015","27","15","5332","","10.1021/acs.chemmater.5b01711","powder diffraction","","1.5418","CuKα","","","","","","","","","0.0092","1.581","","","","","","","has coordinates","231402","2020-10-21","18:00:00",""
"4003170","24.104","0.0015","12.539","0.0008","17.9067","0.0011","90","","113.374","0.003","90","","4968","0.5","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H48 Cu2 I2 N8 O5 -","- C50 H48 Cu2 I2 N8 O5 -","- C200 H192 Cu8 I8 N32 O20 -","4","0.5","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0941","0.0595","","","0.1435","0.1695","","","","","","1.072","","","","has coordinates","231403","2020-10-21","18:00:00",""
"4003171","24.448","0.003","12.4621","0.0012","17.8907","0.0019","90","","113.418","0.005","90","","5001.8","1","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C53 H48 Cu2 I2 N10 O4 -","- C53 H48 Cu2 I2 N10 O4 -","- C212 H192 Cu8 I8 N40 O16 -","4","0.5","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0576","0.0515","","","0.1683","0.1768","","","","","","1.089","","","","has coordinates","231404","2020-10-21","18:00:00",""
"4003172","24.457","0.002","12.2391","0.0011","18.0357","0.0014","90","","113.779","0.005","90","","4940.4","0.7","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 Cu I N3 O3 -","- C24 H21 Cu I N3 O3 -","- C192 H168 Cu8 I8 N24 O24 -","8","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0708","0.0465","","","0.1226","0.141","","","","","","1.051","","","","has coordinates","231405","2020-10-21","18:00:00",""
"4003173","12.681","0.003","13.34","0.003","17.761","0.004","69.389","0.009","89.016","0.01","63.4","0.009","2478.9","1","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H39 Cu2 F I2 N6 O3 -","- C50 H39 Cu2 F I2 N6 O3 -","- C100 H78 Cu4 F2 I4 N12 O6 -","2","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0825","0.0579","","","0.1641","0.184","","","","","","1.062","","","","has coordinates","231406","2020-10-21","18:00:00",""
"4003174","23.8814","0.001","12.9205","0.0005","17.5755","0.0007","90","","112.522","0.002","90","","5009.5","0.4","130","2","130","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H38 Br Cu2 I2 N6 O2 -","- C50 H38 Br Cu2 I2 N6 O2 -","- C200 H152 Br4 Cu8 I8 N24 O8 -","4","0.5","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0895","0.0748","","","0.2224","0.2346","","","","","","1.136","","","","has coordinates","231407","2020-10-21","18:00:00",""
"4003175","24.5691","0.0008","12.317","0.0004","18.0299","0.0006","90","","114.046","0.002","90","","4982.7","0.3","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C59 H34 Cu2 I2 N10 O2 -","- C59 H34 Cu2 I2 N10 O2 -","- C236 H136 Cu8 I8 N40 O8 -","4","0.5","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.066","0.0523","","","0.1382","0.1578","","","","","","1.011","","","","has coordinates","231408","2020-10-21","18:00:00",""
"4003176","23.6086","0.0015","12.9371","0.0008","17.5536","0.0011","90","","112.57","0.003","90","","4950.7","0.5","140","2","140","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H19 Cu I N4 O3 -","- C25 H19 Cu I N4 O3 -","- C200 H152 Cu8 I8 N32 O24 -","8","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.1432","0.0553","","","0.1076","0.1353","","","","","","0.95","","","","has coordinates","231409","2020-10-21","18:00:00",""
"4003177","23.9138","0.0009","12.8156","0.0005","17.636","0.0006","90","","112.655","0.002","90","","4987.9","0.3","130","2","130","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H38 Cl Cu2 I2 N6 O2 -","- C50 H38 Cl Cu2 I2 N6 O2 -","- C200 H152 Cl4 Cu8 I8 N24 O8 -","4","0.5","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0965","0.0676","","","0.203","0.2208","","","","","","1.155","","","","has coordinates","231410","2020-10-21","18:00:00",""
"4003178","24.97","0.05","12.02","0.02","18.21","0.03","90","","113.5","0.03","90","","5012","15","130","2","130","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H23 Cu I N3 O2 S -","- C24 H23 Cu I N3 O2 S -","- C192 H184 Cu8 I8 N24 O16 S8 -","8","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.1996","0.0835","","","0.1672","0.2116","","","","","","0.975","","","","has coordinates","231411","2020-10-21","18:00:00",""
"4003179","24.26","0.003","12.6267","0.0012","17.8971","0.0017","90","","113.86","0.005","90","","5013.8","0.9","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Cu I N4 O3 -","- C28 H22 Cu I N4 O3 -","- C224 H176 Cu8 I8 N32 O24 -","8","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0613","0.0488","","","0.1353","0.1434","","","","","","1.043","","","","has coordinates,has disorder","231412","2020-10-21","18:00:00",""
"4003180","24.404","0.003","12.3305","0.0014","17.9345","0.0019","90","","113.07","0.006","90","","4965.1","1","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 Cu I N6 O -","- C24 H20 Cu I N6 O -","- C192 H160 Cu8 I8 N48 O8 -","8","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.1065","0.0705","","","0.1893","0.2108","","","","","","1.215","","","","has coordinates","231413","2020-10-21","18:00:00",""
"4003181","12.5823","0.0008","13.544","0.0008","17.5152","0.0011","68.665","0.002","89.462","0.002","64.914","0.002","2480.6","0.3","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H44 Cu2 I2 N8 O2 -","- C54 H44 Cu2 I2 N8 O2 -","- C108 H88 Cu4 I4 N16 O4 -","2","1","","Khatua, Sajal; Goswami, Soumyabrata; Biswas, Soumava; Tomar, Kapil; Jena, Himanshu Sekhar; Konar, Sanjit","Stable Multiresponsive Luminescent MOF for Colorimetric Detection of Small Molecules in Selective and Reversible Manner","Chemistry of Materials","2015","27","15","5349","","10.1021/acs.chemmater.5b01773","","","0.71073","MoKα","","0.0384","0.0342","","","0.103","0.1063","","","","","","1.073","","","","has coordinates","231414","2020-10-21","18:00:00",""
"4003182","9.0462","0.0001","22.0677","0.0002","14.1102","0.0001","90","","91.134","0.001","90","","2816.25","0.04","173","0.14","173","0.14","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C40 H28 -","- C40 H28 -","- C160 H112 -","4","1","","He, Zikai; Zhang, Liuqing; Mei, Ju; Zhang, Tian; Lam, Jacky W. Y.; Shuai, Zhigang; Dong, Yong Qiang; Tang, Ben Zhong","Polymorphism-Dependent and Switchable Emission of Butterfly-Like Bis(diarylmethylene)dihydroanthracenes","Chemistry of Materials","2015","27","19","6601","","10.1021/acs.chemmater.5b02280","","x-ray","1.5418","CuKα","","0.0407","0.0383","","","0.0911","0.0927","","","","","","1.005","","","","has coordinates","231415","2020-10-21","18:00:00",""
"4003183","10.4299","0.0016","11.9506","0.0018","13.855","0.002","99.954","0.003","101.968","0.003","107.734","0.003","1556.6","0.4","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","","","- C44 H36 -","- C44 H36 -","- C88 H72 -","2","1","","He, Zikai; Zhang, Liuqing; Mei, Ju; Zhang, Tian; Lam, Jacky W. Y.; Shuai, Zhigang; Dong, Yong Qiang; Tang, Ben Zhong","Polymorphism-Dependent and Switchable Emission of Butterfly-Like Bis(diarylmethylene)dihydroanthracenes","Chemistry of Materials","2015","27","19","6601","","10.1021/acs.chemmater.5b02280","","","0.71073","MoKα","","0.0571","0.0464","","","0.1226","0.1316","","","","","","1.047","","","","has coordinates","231416","2020-10-21","18:00:00",""
"4003184","19.089","0.002","10.2565","0.0013","21.225","0.003","90","","91.282","0.002","90","","4154.5","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C91 H75 Cl9 O8 -","- C91 H75 Cl9 O8 -","- C182 H150 Cl18 O16 -","2","0.5","","He, Zikai; Zhang, Liuqing; Mei, Ju; Zhang, Tian; Lam, Jacky W. Y.; Shuai, Zhigang; Dong, Yong Qiang; Tang, Ben Zhong","Polymorphism-Dependent and Switchable Emission of Butterfly-Like Bis(diarylmethylene)dihydroanthracenes","Chemistry of Materials","2015","27","19","6601","","10.1021/acs.chemmater.5b02280","","","0.71073","MoKα","","0.1023","0.0874","","","0.2494","0.2639","","","","","","1.09","","","","has coordinates,has disorder","231417","2020-10-21","18:00:00",""
"4003185","10.4082","0.0013","10.5164","0.0014","29.494","0.004","90","","93.522","0.002","90","","3222.2","0.7","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C44 H36 -","- C44 H36 -","- C176 H144 -","4","1","","He, Zikai; Zhang, Liuqing; Mei, Ju; Zhang, Tian; Lam, Jacky W. Y.; Shuai, Zhigang; Dong, Yong Qiang; Tang, Ben Zhong","Polymorphism-Dependent and Switchable Emission of Butterfly-Like Bis(diarylmethylene)dihydroanthracenes","Chemistry of Materials","2015","27","19","6601","","10.1021/acs.chemmater.5b02280","","","0.71073","MoKα","","0.0733","0.0487","","","0.1129","0.1267","","","","","","1.013","","","","has coordinates","231418","2020-10-21","18:00:00",""
"4003186","19.988","0.001","19.988","0.001","13.3947","0.0009","90","","90","","90","","5351.5","0.5","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C0.71 O2 Si -","- C0.541667 O2.33333 Si -","- C52 O224 Si96 -","96","12","","Santoro, Mario; Dziubek, Kamil; Scelta, Demetrio; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Rouquette, Jerome; Hermet, Patrick; van der Lee, Arie; Haines, Julien","High Pressure Synthesis of All-Transoid Polycarbonyl [—(C═O)—]n in a Zeolite","Chemistry of Materials","2015","27","19","6486","","10.1021/acs.chemmater.5b02596","","x-ray","1.54184","CuKα","","0.104","0.0918","","","0.2453","0.259","","","","","","1.037","","","","has coordinates","231419","2020-10-21","18:00:00",""
"4003187","4.7594","0.0016","13.444","0.003","16.816","0.006","107.754","0.014","95.034","0.016","90.919","0.019","1019.7","0.6","90","","90","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H44 F6 N2 O4 S2 -","- C48 H44 F6 N2 O4 S2 -","- C48 H44 F6 N2 O4 S2 -","1","0.5","","Nakano, Masahiro; Osaka, Itaru; Hashizume, Daisuke; Takimiya, Kazuo","α-Modified Naphthodithiophene Diimides—Molecular Design Strategy for Air-Stable n-Channel Organic Semiconductors","Chemistry of Materials","2015","27","18","6418","","10.1021/acs.chemmater.5b02601","","","0.71073","MoKα","","0.1792","0.0956","","","0.2605","0.3132","","","","","","1.046","","","","has coordinates,has disorder","231420","2020-10-21","18:00:00",""
"4003188","5.3741","0.0011","8.3251","0.0016","18.155","0.003","93.296","0.01","93.705","0.01","98.532","0.01","799.7","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","DC-NDTI8","DCNDTI","","- C34 H36 Cl2 N2 O4 S2 -","- C34 H36 Cl2 N2 O4 S2 -","- C34 H36 Cl2 N2 O4 S2 -","1","0.5","","Nakano, Masahiro; Osaka, Itaru; Hashizume, Daisuke; Takimiya, Kazuo","α-Modified Naphthodithiophene Diimides—Molecular Design Strategy for Air-Stable n-Channel Organic Semiconductors","Chemistry of Materials","2015","27","18","6418","","10.1021/acs.chemmater.5b02601","","","1.54187","CuKα","","0.1078","0.066","","","0.1725","0.2258","","","","","","1.158","","","","has coordinates,has disorder","231421","2020-10-21","18:00:00",""
"4003189","19.855","0.007","12.366","0.004","10.331","0.003","90","","119.994","0.008","90","","2196.8","1.2","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H36 Au N3 Si2 -","- C15 H36 Au N3 Si2 -","- C60 H144 Au4 N12 Si8 -","4","0.5","","Griffiths, Matthew B. E.; Koponen, Sara E.; Mandia, David J.; McLeod, Jennifer F.; Coyle, Jason P.; Sims, Jeffrey J.; Giorgi, Javier B.; Sirianni, Eric R.; Yap, Glenn P. A.; Barry, Seán T.","Surfactant Directed Growth of Gold Metal Nanoplates by Chemical Vapor Deposition","Chemistry of Materials","2015","27","17","6116","","10.1021/acs.chemmater.5b02712","","","0.71073","MoKα","","0.0148","0.0142","","","0.0363","0.0366","","","","","","1.082","","","","has coordinates","231422","2020-10-21","18:00:00",""
"4003190","9.5789","0.0014","6.9929","0.001","17.858","0.003","90","","91.031","0.002","90","","1196","0.3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 Au Cl N2 -","- C9 H18 Au Cl N2 -","- C36 H72 Au4 Cl4 N8 -","4","1","","Griffiths, Matthew B. E.; Koponen, Sara E.; Mandia, David J.; McLeod, Jennifer F.; Coyle, Jason P.; Sims, Jeffrey J.; Giorgi, Javier B.; Sirianni, Eric R.; Yap, Glenn P. A.; Barry, Seán T.","Surfactant Directed Growth of Gold Metal Nanoplates by Chemical Vapor Deposition","Chemistry of Materials","2015","27","17","6116","","10.1021/acs.chemmater.5b02712","","","0.71073","MoKα","","0.04","0.0258","","","0.0535","0.0588","","","","","","1.031","","","","has coordinates","231423","2020-10-21","18:00:00",""
"4003204","8.8022","0.0002","4.603","0.0001","22.6036","0.0004","90","","90.6026","0.0008","90","","915.77","0.03","101","2","101","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NSz2T","NSz2T","","- C20 H12 N4 S2 Se2 -","- C20 H12 N4 S2 Se2 -","- C40 H24 N8 S4 Se4 -","2","0.5","","Kawashima, Kazuaki; Osaka, Itaru; Takimiya, Kazuo","Effect of Chalcogen Atom on the Properties of Naphthobischalcogenadiazole-Based π-Conjugated Polymers","Chemistry of Materials","2015","27","19","6558","","10.1021/acs.chemmater.5b03124","","","1.54187","CuKα","","0.0386","0.0364","","","0.094","0.1057","","","","","","0.896","","","","has coordinates","231425","2020-10-21","18:00:00",""
"4003205","11.7955","0.0015","8.5619","0.0009","18.814","0.002","90","","106.722","0.0013","90","","1819.7","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","NTz2T","NTz2T","","- C20 H12 N4 S4 -","- C20 H12 N4 S4 -","- C80 H48 N16 S16 -","4","0.5","","Kawashima, Kazuaki; Osaka, Itaru; Takimiya, Kazuo","Effect of Chalcogen Atom on the Properties of Naphthobischalcogenadiazole-Based π-Conjugated Polymers","Chemistry of Materials","2015","27","19","6558","","10.1021/acs.chemmater.5b03124","","","0.7107","MoKα","","0.0499","0.0398","","","0.1043","0.1123","","","","","","0.745","","","","has coordinates","231426","2020-10-21","18:00:00",""
"4003206","4.7463","0.0001","10.0444","0.0002","17.8813","0.0003","90","","96.1637","0.0013","90","","847.54","0.03","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","NOz2T","NOz2T","","- C20 H12 N4 O2 S2 -","- C20 H12 N4 O2 S2 -","- C40 H24 N8 O4 S4 -","2","0.5","","Kawashima, Kazuaki; Osaka, Itaru; Takimiya, Kazuo","Effect of Chalcogen Atom on the Properties of Naphthobischalcogenadiazole-Based π-Conjugated Polymers","Chemistry of Materials","2015","27","19","6558","","10.1021/acs.chemmater.5b03124","","","1.54187","CuKα","","0.0543","0.0451","","","0.1123","0.1195","","","","","","1.05","","","","has coordinates","231427","2020-10-21","18:00:00",""
"4003207","6.1351","0.0001","8.9483","0.0002","12.4437","0.0003","93.009","0.001","99.232","0.001","94.8946","0.0016","670.31","0.02","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H34 N6 S2 Sn2 -","- C22 H34 N6 S2 Sn2 -","- C22 H34 N6 S2 Sn2 -","1","0.5","","Ahmet, Ibbi Y.; Hill, Michael S.; Johnson, Andrew L.; Peter, Laurence M.","Polymorph-Selective Deposition of High Purity SnS Thin Films from a Single Source Precursor","Chemistry of Materials","2015","27","22","7680","","10.1021/acs.chemmater.5b03220","","","0.71073","MoKα","","0.0467","0.0437","","","0.1103","0.1118","","","","","","1.174","","","","has coordinates","231428","2020-10-21","18:00:00",""
"4003208","3.629473","","9.812765","","18.426905","","90","","90","","118.042","","579.231","","","","","","","","","","","","","3","P 1 1 21/b","-P 2bc","14","","","","- C5 N5 O -","- C20 N20 O4 -","- C20 N20 O4 -","1","0.25","","Hirsch, Anna; Gur, Dvir; Polishchuk, Iryna; Levy, Davide; Pokroy, Boaz; Cruz-Cabeza, Aurora J.; Addadi, Lia; Kronik, Leeor; Leiserowitz, Leslie","“Guanigma”: The Revised Structure of Biogenic Anhydrous Guanine","Chemistry of Materials","2015","27","24","8289","","10.1021/acs.chemmater.5b03549","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","231429","2020-10-21","18:00:00",""
"4003209","11.824","0.005","11.824","0.005","11.824","0.005","90","","90","","90","","1653.1","1.2","100","","100","","","","","","","","","6","P m -3 m","-P 4 2 3","221","","","","- C0.17 H0.5 F0.1 N0.04 O2 Si -","- C0.1666 H0.4998 F0.10325 N0.0416667 O2 Si -","- C3.9984 H11.9952 F2.478 N O48 Si24 -","24","0.5","","Boal, Ben W.; Schmidt, Joel E.; Deimund, Mark A.; Deem, Michael W.; Henling, Lawrence M.; Brand, Stephen K.; Zones, Stacey I.; Davis, Mark E.","Facile Synthesis and Catalysis of Pure-Silica and Heteroatom LTA","Chemistry of Materials","2015","27","22","7774","","10.1021/acs.chemmater.5b03579","","","0.71073","MoKα","","0.0427","0.0296","","","0.075","0.0798","","","","","","1.123","","","","has coordinates,has disorder","231430","2020-10-21","18:00:00",""
"4003210","11.857","0.004","11.857","0.004","11.857","0.004","90","","90","","90","","1667","1","100","","100","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- O2 Si -","- O2 Si -","- O48 Si24 -","24","0.5","","Boal, Ben W.; Schmidt, Joel E.; Deimund, Mark A.; Deem, Michael W.; Henling, Lawrence M.; Brand, Stephen K.; Zones, Stacey I.; Davis, Mark E.","Facile Synthesis and Catalysis of Pure-Silica and Heteroatom LTA","Chemistry of Materials","2015","27","22","7774","","10.1021/acs.chemmater.5b03579","","","0.71073","MoKα","","0.085","0.0449","","","0.0833","0.0933","","","","","","1.152","","","","has coordinates","231431","2020-10-21","18:00:00",""
"4003211","11.813","0.003","11.813","0.003","11.813","0.003","90","","90","","90","","1648.5","0.7","100","","100","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- F0.08 O2 Si -","- F0.08425 O2 Si -","- F2.022 O48 Si24 -","24","0.5","","Boal, Ben W.; Schmidt, Joel E.; Deimund, Mark A.; Deem, Michael W.; Henling, Lawrence M.; Brand, Stephen K.; Zones, Stacey I.; Davis, Mark E.","Facile Synthesis and Catalysis of Pure-Silica and Heteroatom LTA","Chemistry of Materials","2015","27","22","7774","","10.1021/acs.chemmater.5b03579","","","0.71073","MoKα","","0.0623","0.0497","","","0.1145","0.1188","","","","","","1.099","","","","has coordinates","231432","2020-10-21","18:00:00",""
"4003212","5.0182","0.0006","5.0182","0.0006","8.355","0.002","90","","90","","120","","182.21","0.05","293","2","293","2","","","","","","","","5","P -6 c 2","P -6c 2","188","","","","- C F K O3 Zn -","- C F K O3 Zn -","- C2 F2 K2 O6 Zn2 -","2","0.166667","","Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao","Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series","Chemistry of Materials","2015","27","21","7520","","10.1021/acs.chemmater.5b03890","","","0.71073","MoKα","","0.0107","0.0106","","","0.0233","0.0234","","","","","","1.018","","","","has coordinates","231433","2020-10-21","18:00:00",""
"4003213","5.1349","0.0013","5.1349","0.0013","8.846","0.004","90","","90","","120","","202","0.12","293","2","293","2","","","","","","","","5","P -6 c 2","P -6c 2","188","","","","- C Cd F K O3 -","- C Cd F K O3 -","- C2 Cd2 F2 K2 O6 -","2","0.166667","","Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao","Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series","Chemistry of Materials","2015","27","21","7520","","10.1021/acs.chemmater.5b03890","","","0.71073","MoKα","","0.0105","0.0104","","","0.0247","0.0247","","","","","","1.227","","","","has coordinates","231434","2020-10-21","18:00:00",""
"4003214","5.2109","0.0007","5.2109","0.0007","9.0645","0.0019","90","","90","","120","","213.16","0.06","293","2","293","2","","","","","","","","5","P -6 c 2","P -6c 2","188","","","","- C Cd F O3 Rb -","- C Cd F O3 Rb -","- C2 Cd2 F2 O6 Rb2 -","2","0.166667","","Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao","Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series","Chemistry of Materials","2015","27","21","7520","","10.1021/acs.chemmater.5b03890","","","0.71073","MoKα","","0.0128","0.0116","","","0.0244","0.025","","","","","","1.183","","","","has coordinates","231435","2020-10-21","18:00:00",""
"4003215","5.1035","0.0009","5.1035","0.0009","8.619","0.004","90","","90","","120","","194.41","0.1","293","2","293","2","","","","","","","","5","P -6 c 2","P -6c 2","188","","","","- C F O3 Rb Zn -","- C F O2.997 Rb Zn -","- C2 F2 O5.994 Rb2 Zn2 -","2","0.166667","","Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao","Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series","Chemistry of Materials","2015","27","21","7520","","10.1021/acs.chemmater.5b03890","","","0.71073","MoKα","","0.0228","0.0172","","","0.032","0.0332","","","","","","1.01","","","","has coordinates,has disorder","231436","2020-10-21","18:00:00",""
"4003419","5.09","0.0002","9.28","0.0003","9.3946","0.0003","84.733","0.001","84.283","0.001","89.235","0.001","439.68","0.03","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C4 H12 Au2 Cl4 Cu N4 O6 -","- C4 H12 Au2 Cl4 Cu N4 O6 -","- C4 H12 Au2 Cl4 Cu N4 O6 -","1","0.5","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0226","0.0211","","","0.0518","0.0524","","","","","","1.177","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003420","8.4718","0.0001","8.612","0.0001","10.6612","0.0001","86.056","0.001","81.895","0.001","86.063","0.001","766.869","0.015","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H28 Au2 Cl4 Cu N8 O4 -","- C16 H28 Au2 Cl4 Cu N8 O4 -","- C16 H28 Au2 Cl4 Cu N8 O4 -","1","0.5","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0368","0.0263","","","0.0642","0.0674","","","","","","1.059","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003421","8.3765","0.0002","8.4243","0.0002","10.8307","0.0003","90.153","0.002","92.457","0.002","92.463","0.001","762.86","0.03","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H28 Au2 Br4 Cu N8 O4 -","- C16 H28 Au2 Br4 Cu N8 O4 -","- C16 H28 Au2 Br4 Cu N8 O4 -","1","0.5","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0354","0.0266","","","0.0633","0.0656","","","","","","1.065","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003422","8.2802","0.0007","8.508","0.0007","11.2279","0.0009","80.18","0.0019","79.306","0.002","86.825","0.0019","765.63","0.11","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C12 H24 Au2 Br4 Cu N4 O4 S4 -","- C12 H24 Au2 Br4 Cu N4 O4 S4 -","- C12 H24 Au2 Br4 Cu N4 O4 S4 -","1","0.5","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0631","0.0422","","","0.1043","0.1138","","","","","","1.037","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003423","11.6264","0.00015","8.091","0.0001","14.8596","0.00019","90","","104.857","0.0006","90","","1351.1","0.03","299","2","299","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Au2 Br4 Cu N4 O8 -","- C12 H24 Au2 Br4 Cu N4 O8 -","- C24 H48 Au4 Br8 Cu2 N8 O16 -","2","0.5","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0722","0.0345","","","0.0559","0.0636","","","","","","1.007","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003424","19.8327","0.0004","13.9821","0.0003","19.8634","0.0005","90","","118.153","0.001","90","","4856.51","0.19","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 Au2 Cl4 Cu N4 O6 -","- C12 H20 Au2 Cl4 Cu N4 O6 -","- C96 H160 Au16 Cl32 Cu8 N32 O48 -","8","2","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0369","0.0304","","","0.0588","0.0608","","","","","","1.067","","","","has coordinates","239741","2020-10-21","18:00:00",""
"4003425","18.5292","0.0003","18.5292","0.0003","19.6529","0.0004","90","","90","","120","","5843.47","0.18","150","2","150","2","","","","","","","","6","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C62 H62 Au6 Cu3 N22 O6 -","- C62 H62 Au6 Cu3 N22 O6 -","- C186 H186 Au18 Cu9 N66 O18 -","3","0.25","","Ovens, Jeffrey S.; Leznoff, Daniel B.","Raman Detected Sensing of Volatile Organic Compounds by Vapochromic Cu[AuX2(CN)2]2 (X = Cl, Br) Coordination Polymer Materials","Chemistry of Materials","2015","27","5","1465","","10.1021/cm502998w","","","0.71073","MoKα","","0.0434","0.03","","","0.064","0.0713","","","","","","1.202","","","","has coordinates","239741","2020-10-21","18:00:00",""