# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T04:42:24+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Chemistry of Materials') AND volume = 26 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
"4001863","28.715","0.004","8.5084","0.0013","25.367","0.004","90","","90","","90","","6197.6","1.6","293.15","","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- Ba8 S15 Sn4 -","- Ba8 S15 Sn4 -","- Ba64 S120 Sn32 -","8","2","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","Ba8Sn4S15: A Strong Second Harmonic Generation Sulfide with Zero-Dimensional Crystal Structure","Chemistry of Materials","2014","26","2","1093","","10.1021/cm403369m","","","0.71073","MoKα","","0.0235","0.0221","","","0.042","0.0425","","","","","","1.007","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001864","14.752","0.003","4.7121","0.001","17.372","0.003","90","","104.402","0.005","90","","1169.6","0.4","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 N8 Ni -","- C32 H16 N8 Ni -","- C64 H32 N16 Ni2 -","2","0.5","","Takahashi, Yukihiro; Hayakawa, Kei; Takayama, Katsuya; Yokokura, Seiya; Harada, Jun; Hasegawa, Hiroyuki; Inabe, Tamotsu","Charge Conduction Properties at the Contact Interface between (Phthalocyaninato)nickel(II) and Electron Acceptor Single Crystals","Chemistry of Materials","2014","26","2","993","","10.1021/cm403033b","","","0.71075","MoKα","","","0.0504","","","","0.0875","","","","","","0.975","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001865","4.2387","0.0002","4.2387","0.0002","4.2387","0.0002","90","","90","","90","","76.155","0.006","300","2","300","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ga3 Ho Mn0.08 -","- Ga3 Ho Mn0.077 -","- Ga3 Ho Mn0.077 -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","","0.71073","MoKα","","0.0106","0.0106","","","0.0255","0.0255","","","","","","1.384","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001866","4.2516","0.0001","4.2516","0.0001","4.2516","0.0001","90","","90","","90","","76.852","0.003","293","","293","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ga3 Ho Mn0.152 -","- Ga3 Ho Mn0.152 -","- Ga3 Ho Mn0.152 -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","x-ray","0.71073","MoKα","","0.0114","0.0114","","","0.0129","0.0129","","","","1.28","1.28","1.28","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001867","4.2149","0.001","4.2149","0.001","4.2149","0.001","90","","90","","90","","74.88","0.03","293","2","293","2","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Er Ga3 -","- Er Ga3 -","- Er Ga3 -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","","0.71073","MoKα","","0.0134","0.0134","","","0.036","0.036","","","","","","1.412","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001868","4.2303","0.0003","4.2303","0.0003","4.2303","0.0003","90","","90","","90","","75.703","0.009","300","2","300","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Er Ga3 Mn0.03 -","- Er Ga3 Mn0.041 -","- Er Ga3 Mn0.041 -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","","0.71073","MoKα","","0.0202","0.0202","","","0.0484","0.0484","","","","","","1.187","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001869","4.2351","0.0001","4.2351","0.0001","4.2351","0.0001","90","","90","","90","","75.961","0.003","293","","293","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Er Ga3 Mn0.118 -","- Er Ga3 Mn0.118 -","- Er Ga3 Mn0.118 -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","x-ray","0.71073","MoKα","","0.0095","0.0095","","","0.0095","0.0095","","","","1.23","1.23","1.23","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001870","4.2027","0.001","4.2027","0.001","4.2027","0.001","90","","90","","90","","74.23","0.03","293","2","293","2","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ga3 Tm -","- Ga3 Tm -","- Ga3 Tm -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","","0.71073","MoKα","","0.0266","0.0266","","","0.0765","0.0765","","","","","","1.291","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001871","4.2085","0.0004","4.2085","0.0004","4.2085","0.0004","90","","90","","90","","74.539","0.012","300","2","300","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ga3 Mn0.05 Tm -","- Ga3 Mn0.049 Tm -","- Ga3 Mn0.049 Tm -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","","0.71073","MoKα","","0.0087","0.0087","","","0.0152","0.0152","","","","","","1.14","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001872","4.2195","","4.2195","","4.2195","","90","","90","","90","","75.125","","293","","293","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","","","- Ga3 Mn0.095 Tm -","- Ga2.997 Mn0.095 Tm -","- Ga2.997 Mn0.095 Tm -","1","0.0208333","","Fulfer, Bradford W.; McAlpin, Jacob D.; Engelkemier, Joshua; McCandless, Gregory T.; Prestigiacomo, Joseph; Stadler, Shane; Fredrickson, Daniel C.; Chan, Julia Y.","Filling in the Holes: Structural and Magnetic Properties of the Chemical Pressure Stabilized LnMnxGa3(Ln = Ho‒Tm;x< 0.15)","Chemistry of Materials","2014","26","2","1170","","10.1021/cm4035424","","x-ray","0.71069","MoKα","","0.014","0.014","","","0.0133","0.0133","","","","1.15","1.15","1.15","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001873","13.7665","0.0014","13.8428","0.0014","21.58","0.002","75.2984","0.0015","80.5562","0.0015","60.6775","0.0014","3464.3","0.6","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C49 H111 Cl2 O16 Si4 Y -","- C49 H111 Cl2 O16 Si4 Y -","- C98 H222 Cl4 O32 Si8 Y2 -","2","1","","Lapadula, Giuseppe; Bourdolle, Adrien; Allouche, Florian; Conley, Matthew P.; del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Guyot, Yannick; Andraud, Chantal; Brasselet, Sophie; Copéret, Christophe; Maury, Olivier; Andersen, Richard A.","Near-IR Two Photon Microscopy Imaging of Silica Nanoparticles Functionalized with Isolated Sensitized Yb(III) Centers","Chemistry of Materials","2014","26","2","1062","","10.1021/cm404140q","","","0.71073","MOKα","","0.0468","0.0358","","","0.0898","0.0947","","","","","","0.986","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001874","19.12","0.002","13.9438","0.0017","23.307","0.003","90","","106.467","0.0017","90","","5958.9","1.2","296","2","296.15","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C48 H93 N2 O12 Si3 Yb -","- C48 H93 N2 O12 Si3 Yb -","- C192 H372 N8 O48 Si12 Yb4 -","4","1","","Lapadula, Giuseppe; Bourdolle, Adrien; Allouche, Florian; Conley, Matthew P.; del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Guyot, Yannick; Andraud, Chantal; Brasselet, Sophie; Copéret, Christophe; Maury, Olivier; Andersen, Richard A.","Near-IR Two Photon Microscopy Imaging of Silica Nanoparticles Functionalized with Isolated Sensitized Yb(III) Centers","Chemistry of Materials","2014","26","2","1062","","10.1021/cm404140q","","","0.71073","MOKα","","0.0779","0.0705","","","0.1515","0.1544","","","","","","1.308","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001875","19.1651","0.0017","13.9306","0.0012","23.309","0.002","90","","106.35","0.0014","90","","5971.4","0.9","100","2","100","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C48 H93 N2 O12 Si3 Y -","- C48 H93 N2 O12 Si3 Y -","- C192 H372 N8 O48 Si12 Y4 -","4","1","","Lapadula, Giuseppe; Bourdolle, Adrien; Allouche, Florian; Conley, Matthew P.; del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Guyot, Yannick; Andraud, Chantal; Brasselet, Sophie; Copéret, Christophe; Maury, Olivier; Andersen, Richard A.","Near-IR Two Photon Microscopy Imaging of Silica Nanoparticles Functionalized with Isolated Sensitized Yb(III) Centers","Chemistry of Materials","2014","26","2","1062","","10.1021/cm404140q","","","0.71073","MoKα","","0.0819","0.0756","","","0.166","0.1683","","","","","","1.274","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001876","13.7858","0.0013","14.6169","0.0013","17.5171","0.0016","97.9411","0.0012","91.888","0.0013","99.4943","0.0013","3442.4","0.5","100","","100","","","","","","","","","6","P 1","P 1","1","","","","- C49 H111 Cl2 O16 Si4 Yb -","- C49 H111 Cl2 O16 Si4 Yb -","- C98 H222 Cl4 O32 Si8 Yb2 -","2","2","","Lapadula, Giuseppe; Bourdolle, Adrien; Allouche, Florian; Conley, Matthew P.; del Rosal, Iker; Maron, Laurent; Lukens, Wayne W.; Guyot, Yannick; Andraud, Chantal; Brasselet, Sophie; Copéret, Christophe; Maury, Olivier; Andersen, Richard A.","Near-IR Two Photon Microscopy Imaging of Silica Nanoparticles Functionalized with Isolated Sensitized Yb(III) Centers","Chemistry of Materials","2014","26","2","1062","","10.1021/cm404140q","","","0.71073","MoKα","","0.027","0.024","","","0.0575","0.0596","","","","","","1.074","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001877","9.469","0.0013","9.469","0.0013","22.233","0.004","90","","90","","120","","1726.4","0.5","100","2","100","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C19 H12 N2 Ni O6 -","- C19.16 H1.5 N2 Ni O6 -","- C38.32 H3 N4 Ni2 O12 -","2","0.0833333","","Jeong, Seok; Kim, Dongwook; Shin, Sunyoung; Moon, Dohyun; Cho, Sung June; Lah, Myoung Soo","Combinational Synthetic Approaches for Isoreticular and Polymorphic Metal‒Organic Frameworks with Tuned Pore Geometries and Surface Properties","Chemistry of Materials","2014","26","4","1711","","10.1021/cm404239s","","","0.89999","synchrotron","","0.1953","0.1715","","","0.4489","0.4735","","","","","","1.844","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4001878","16.571","0.002","16.571","0.002","6.9253","0.0014","90","","90","","120","","1646.9","0.4","173","2","173","2","","","","","","","","5","P -6 2 m","P -6 -2","189","","","","- C13 H8 N2 Ni O6 -","- C13 H3 N2 Ni O6 -","- C39 H9 N6 Ni3 O18 -","3","0.25","","Jeong, Seok; Kim, Dongwook; Shin, Sunyoung; Moon, Dohyun; Cho, Sung June; Lah, Myoung Soo","Combinational Synthetic Approaches for Isoreticular and Polymorphic Metal‒Organic Frameworks with Tuned Pore Geometries and Surface Properties","Chemistry of Materials","2014","26","4","1711","","10.1021/cm404239s","","","0.71073","MoKα","","0.1034","0.099","","","0.2459","0.2496","","","","","","1.104","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001879","28.773","0.006","16.615","0.003","16.794","0.003","90","","124.45","0.03","90","","6621","3","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C39 H24 N6 Ni3 O18 -","- C39 H21 N6 Ni3 O18 -","- C156 H84 N24 Ni12 O72 -","4","1","","Jeong, Seok; Kim, Dongwook; Shin, Sunyoung; Moon, Dohyun; Cho, Sung June; Lah, Myoung Soo","Combinational Synthetic Approaches for Isoreticular and Polymorphic Metal‒Organic Frameworks with Tuned Pore Geometries and Surface Properties","Chemistry of Materials","2014","26","4","1711","","10.1021/cm404239s","","","0.65","synchrotron","","0.2404","0.1554","","","0.354","0.4137","","","","","","1.007","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4001880","9.5935","0.0014","9.5935","0.0014","13.836","0.003","90","","90","","120","","1102.8","0.3","173","2","173","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- C13 H8 N2 Ni O6 -","- C12.96 H1.5 N2 Ni O6 -","- C25.92 H3 N4 Ni2 O12 -","2","0.0833333","","Jeong, Seok; Kim, Dongwook; Shin, Sunyoung; Moon, Dohyun; Cho, Sung June; Lah, Myoung Soo","Combinational Synthetic Approaches for Isoreticular and Polymorphic Metal‒Organic Frameworks with Tuned Pore Geometries and Surface Properties","Chemistry of Materials","2014","26","4","1711","","10.1021/cm404239s","","","0.66999","synchrotron","","0.0989","0.0811","","","0.2371","0.2491","","","","","","1.124","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4001881","5.8797","0.0008","5.8797","0.0008","13.72","0.003","90","","90","","120","","410.77","0.12","293","2","293","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ge2 K Mn3 O9 -","- Ge2 K Mn3 O8.99 -","- Ge4 K2 Mn6 O17.98 -","2","0.0833333","","Williams, Matthew S.; West, J. Palmer; Hwu, Shiou-Jyh","KMn3O2(Ge2O7): AnS= 2 Magnetic Insulator Featuring Pillared Kagome Lattice","Chemistry of Materials","2014","26","4","1502","","10.1021/cm403237u","","","0.71073","MoKα","","0.0269","0.0255","","","0.0589","0.0601","","","","","","1.184","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001882","5.8841","0.0008","5.8841","0.0008","13.795","0.003","90","","90","","120","","413.63","0.12","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","","","- Ge2 K0.35 Mn3 O9 Rb0.65 -","- Ge2 K0.353 Mn3 O8.99 Rb0.647 -","- Ge4 K0.706 Mn6 O17.98 Rb1.294 -","2","0.0833333","","Williams, Matthew S.; West, J. Palmer; Hwu, Shiou-Jyh","KMn3O2(Ge2O7): AnS= 2 Magnetic Insulator Featuring Pillared Kagome Lattice","Chemistry of Materials","2014","26","4","1502","","10.1021/cm403237u","","","0.71073","MoKα","","0.0311","0.0303","","","0.0716","0.0721","","","","","","1.217","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001883","31.8334","0.0016","4.6419","0.0002","12.1497","0.0006","90","","109.391","0.001","90","","1693.49","0.14","89","","89","","","","","","","","","4","C 1 2/m 1","-C 2y","12","Europium Cadmium Antimonide/Arsenide","Eu11 Cd6 Sb7.76 As4.24","","- As4.23 Cd6 Eu11 Sb7.77 -","- As4.214 Cd6 Eu11 Sb7.786 -","- As8.428 Cd12 Eu22 Sb15.572 -","2","0.25","","Kazem, Nasrin; Xie, Weiwei; Ohno, Saneyuki; Zevalkink, Alexandra; Miller, Gordon J.; Snyder, G. Jeffrey; Kauzlarich, Susan M.","High-Temperature Thermoelectric Properties of the Solid‒Solution Zintl Phase Eu11Cd6Sb12‒xAsx(x< 3)","Chemistry of Materials","2014","26","3","1393","","10.1021/cm403345a","","","0.71073","MoKα","","0.0262","0.0213","","","0.0419","0.0428","","","","","","1.179","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001884","32.1261","0.0012","4.6788","0.0002","12.258","0.0005","90","","109.572","0.001","90","","1736.06","0.12","89","2","89","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Europium Cadmium Antimonide/Arsenide","","","- As4.82 Cd6 Eu11 Sb19.18 -","- As2.382 Cd6 Eu11 Sb9.618 -","- As4.764 Cd12 Eu22 Sb19.236 -","2","0.25","","Kazem, Nasrin; Xie, Weiwei; Ohno, Saneyuki; Zevalkink, Alexandra; Miller, Gordon J.; Snyder, G. Jeffrey; Kauzlarich, Susan M.","High-Temperature Thermoelectric Properties of the Solid‒Solution Zintl Phase Eu11Cd6Sb12‒xAsx(x< 3)","Chemistry of Materials","2014","26","3","1393","","10.1021/cm403345a","","","0.71073","MoKα","","0.0252","0.0213","","","0.0399","0.041","","","","","","1.071","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001885","32.3403","0.0011","4.704","0.0002","12.3358","0.0004","90","","109.74","","90","","1766.35","0.11","98","2","98","","","","","","","","","4","C 1 2/m 1","-C 2y","12","Europium Cadmium Antimonide/Arsenide","","","- As1.01 Cd6 Eu11 Sb10.98 -","- As1.018 Cd6 Eu11 Sb10.982 -","- As2.036 Cd12 Eu22 Sb21.964 -","2","0.25","","Kazem, Nasrin; Xie, Weiwei; Ohno, Saneyuki; Zevalkink, Alexandra; Miller, Gordon J.; Snyder, G. Jeffrey; Kauzlarich, Susan M.","High-Temperature Thermoelectric Properties of the Solid‒Solution Zintl Phase Eu11Cd6Sb12‒xAsx(x< 3)","Chemistry of Materials","2014","26","3","1393","","10.1021/cm403345a","","","0.71073","MoKα","","0.0188","0.0176","","","0.0323","0.0326","","","","","","1.285","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001886","18.741","0.007","18.741","0.007","9.414","0.004","90","","90","","90","","3306","2","93","2","93","2","","","","","","","","6","P 4/n :2","-P 4a","85","Cu-SAPO STA-7, dehydrated 250 degree C","Cu-SAPO STA-7, dehydrated 250 degree C","","- C8 Al12 Cu0.32 N5 O48 P12 -","- C8 Al12 Cu0.32 N5 O48 P12 -","- C16 Al24 Cu0.64 N10 O96 P24 -","2","0.25","","Eschenroeder, Eike C. V.; Turrina, Alessandro; Picone, A. Lorena; Cinque, Gianfelice; Frogley, Mark D.; Cox, Paul A.; Howe, Russell F.; Wright, Paul A.","Monitoring the Activation of Copper-Containing Zeotype Catalysts Prepared by Direct Synthesis Using in Situ Synchrotron Infrared Microcrystal Spectroscopy and Complementary Techniques","Chemistry of Materials","2014","26","3","1434","","10.1021/cm403534b","","","0.71073","MoKα","","0.2442","0.1357","","","0.329","0.3441","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001887","18.698","0.006","18.698","0.006","9.395","0.003","90","","90","","90","","3284.6","1.8","293","2","293","2","","","","","","","","6","P 4/n :2","-P 4a","85","Cu-SAPO STA-7, dehydrated 150 degree C","Cu-SAPO STA-7, dehydrated 150 degree C","","- C12 Al12 Cu0.38 N5 O49 P12 -","- C8 Al12 Cu0.382 N5 O49 P12 -","- C16 Al24 Cu0.764 N10 O98 P24 -","2","0.25","","Eschenroeder, Eike C. V.; Turrina, Alessandro; Picone, A. Lorena; Cinque, Gianfelice; Frogley, Mark D.; Cox, Paul A.; Howe, Russell F.; Wright, Paul A.","Monitoring the Activation of Copper-Containing Zeotype Catalysts Prepared by Direct Synthesis Using in Situ Synchrotron Infrared Microcrystal Spectroscopy and Complementary Techniques","Chemistry of Materials","2014","26","3","1434","","10.1021/cm403534b","","","0.71073","MoKα","","0.1364","0.1153","","","0.2691","0.2811","","","","","","1.269","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001888","18.71193","0.00004","18.71193","0.00004","9.39907","0.00004","90","","90","","90","","3290.96","0.017","295","","295","","","","","","","","Hydrothermally synthesized","7","P 4/n :2","-P 4a","85","Cu-SAPO STA-7","SAPO SAV framework","","- C18 Al12 Cu N5 O51.15 P8.4 Si3.6 -","- C18 Al12 Cu N5 O51.1467 P8.4 Si3.6 -","- C36 Al24 Cu2 N10 O102.293 P16.8 Si7.2 -","2","0.25","","Eschenroeder, Eike C. V.; Turrina, Alessandro; Picone, A. Lorena; Cinque, Gianfelice; Frogley, Mark D.; Cox, Paul A.; Howe, Russell F.; Wright, Paul A.","Monitoring the Activation of Copper-Containing Zeotype Catalysts Prepared by Direct Synthesis Using in Situ Synchrotron Infrared Microcrystal Spectroscopy and Complementary Techniques","Chemistry of Materials","2014","26","3","1434","","10.1021/cm403534b","powder diffraction","x-ray","0.800178","","","","","","","","","0.12765","","5.27","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001889","5.226","0.001","10.949","0.002","13.701","0.002","77.27","0.03","79.54","0.01","76.57","0.02","736.7","0.2","93","","93","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H44 N2 O6 -","- C32 H44 N2 O6 -","- C32 H44 N2 O6 -","1","0.5","","Chen, Guo; Sasabe, Hisahiro; Sasaki, Yusuke; Katagiri, Hiroshi; Wang, Xiao-Feng; Sano, Takeshi; Hong, Ziruo; Yang, Yang; Kido, Junji","A Series of Squaraine Dyes: Effects of Side Chain and the Number of Hydroxyl Groups on Material Properties and Photovoltaic Performance","Chemistry of Materials","2014","26","3","1356","","10.1021/cm4034929","","","0.71075","MoKα","","0.0795","0.0585","","","0.1485","0.1826","","","","","","0.959","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001890","9.148","0.006","19.763","0.011","9.189","0.008","90","","119.657","0.006","90","","1443.7","1.8","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 N2 O4 -","- C32 H44 N2 O4 -","- C64 H88 N4 O8 -","2","0.5","","Chen, Guo; Sasabe, Hisahiro; Sasaki, Yusuke; Katagiri, Hiroshi; Wang, Xiao-Feng; Sano, Takeshi; Hong, Ziruo; Yang, Yang; Kido, Junji","A Series of Squaraine Dyes: Effects of Side Chain and the Number of Hydroxyl Groups on Material Properties and Photovoltaic Performance","Chemistry of Materials","2014","26","3","1356","","10.1021/cm4034929","","","0.71075","MoKα","","0.0665","0.0503","","","0.1114","0.1201","","","","","","1.12","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001891","8.9784","0.0002","19.4936","0.0004","8.8957","0.0002","90","","116.234","0.001","90","","1396.57","0.05","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 N2 O2 -","- C32 H44 N2 O2 -","- C64 H88 N4 O4 -","2","0.5","","Chen, Guo; Sasabe, Hisahiro; Sasaki, Yusuke; Katagiri, Hiroshi; Wang, Xiao-Feng; Sano, Takeshi; Hong, Ziruo; Yang, Yang; Kido, Junji","A Series of Squaraine Dyes: Effects of Side Chain and the Number of Hydroxyl Groups on Material Properties and Photovoltaic Performance","Chemistry of Materials","2014","26","3","1356","","10.1021/cm4034929","","","1.54187","CuKα","","0.0413","0.0382","","","0.095","0.0978","","","","","","1.079","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001892","34.6853","0.0006","34.6853","0.0006","50.6917","0.0013","90","","90","","90","","60986","2","100","2","100.01","","","","","","","","","5","I 4/m","-I 4","87","","","","- C192 H96 Cu12 N40 O60 -","- C192 H96 Cu12 N40 O60 -","- C768 H384 Cu48 N160 O240 -","4","0.25","","Barin, Gokhan; Krungleviciute, Vaiva; Gomez-Gualdron, Diego A.; Sarjeant, Amy A.; Snurr, Randall Q.; Hupp, Joseph T.; Yildirim, Taner; Farha, Omar K.","Isoreticular Series of (3,24)-Connected Metal‒Organic Frameworks: Facile Synthesis and High Methane Uptake Properties","Chemistry of Materials","2014","26","5","1912","","10.1021/cm404155s","","","1.54178","CuKα","","0.1075","0.0735","","","0.217","0.2337","","","","","","0.868","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001906","28.7093","0.0006","3.82563","0.00007","20.6241","0.0004","90","","90","","90","","2265.17","0.08","","","","","","","","","","","","3","A m m a","-A 2a 2a","63","","","","- Fe Nb11 O29 -","- Fe Nb11 O29 -","- Fe4 Nb44 O116 -","4","0.25","","Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M.","Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications","Chemistry of Materials","2014","26","6","2203","","10.1021/cm500442j","powder diffraction","","","","","","","","","","","","","1.44","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001907","28.4036","0.0004","4.08447","0.00008","20.70671","0.00019","90","","90","","90","","2402.26","0.06","","","","","","","","","","","","4","A m m a","-A 2a 2a","63","","","","- Fe Li11 Nb11 O29 -","- Fe0.996 Li11 Nb11.004 O29 -","- Fe3.984 Li44 Nb44.016 O116 -","4","0.25","","Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M.","Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications","Chemistry of Materials","2014","26","6","2203","","10.1021/cm500442j","powder diffraction","neutron","","","","","","","","","","0.09172","","2.23","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001908","5.1645","0.0004","7.8154","0.0006","8.1013","0.0006","62.654","0.002","73.88","0.002","85.266","0.002","278.64","0.04","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Yttrium copper tellurite sulfate","","","- Cu O14 S2 Te2 Y2 -","- Cu O14 S2 Te2 Y2 -","- Cu O14 S2 Te2 Y2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0263","0.0201","","","0.0407","0.0424","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001909","5.2397","0.0005","8.008","0.0008","8.301","0.0008","62.268","0.001","74.022","0.001","85.499","0.001","295.88","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Neodymium copper tellurite sulfate","","","- Cu Nd2 O14 S2 Te2 -","- Cu Nd2 O14 S2 Te2 -","- Cu Nd2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.022","0.0219","","","0.0568","0.0569","","","","","","1.271","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001910","5.214","0.0006","7.9348","0.0009","8.2384","0.0009","62.411","0.001","73.982","0.001","85.422","0.001","289.89","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Samarium copper tellurite sulfate","","","- Cu O14 S2 Sm2 Te2 -","- Cu O14 S2 Sm2 Te2 -","- Cu O14 S2 Sm2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","","","0.0196","0.0194","","","0.0504","0.0505","","","","","","1.191","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4001911","5.2216","0.0009","7.9072","0.0014","8.1991","0.0015","62.69","0.002","73.811","0.002","85.453","0.002","288.4","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Europium copper tellurite sulfate","","","- Cu Eu2 O14 S2 Te2 -","- Cu Eu2 O14 S2 Te2 -","- Cu Eu2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0263","0.0231","","","0.0556","0.0574","","","","","","1.065","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001912","5.1886","0.0007","7.8776","0.0011","8.1516","0.0011","62.344","0.001","74.031","0.001","85.319","0.001","283.32","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Gadolinium copper tellurite sulfate","","","- Cu Gd2 O14 S2 Te2 -","- Cu Gd2 O14 S2 Te2 -","- Cu Gd2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0241","0.0238","","","0.0586","0.0588","","","","","","1.21","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001913","5.1939","0.0009","7.8689","0.0013","8.1664","0.0014","62.602","0.002","73.928","0.002","85.34","0.002","284.33","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Terbium copper tellurite sulfate","","","- Cu O14 S2 Tb2 Te2 -","- Cu O14 S2 Tb2 Te2 -","- Cu O14 S2 Tb2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0215","0.0182","","","0.0396","0.0406","","","","","","1.044","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001914","5.1706","0.001","7.8301","0.0015","8.1176","0.0016","62.479","0.002","73.957","0.002","85.171","0.002","279.75","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Dysprosium copper tellurite sulfate","","","- Cu Dy2 O14 S2 Te2 -","- Cu Dy2 O14 S2 Te2 -","- Cu Dy2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0209","0.0207","","","0.0526","0.0527","","","","","","1.162","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001915","5.179","0.004","7.814","0.006","8.108","0.006","62.793","0.006","73.836","0.007","85.241","0.007","279.9","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Holmium copper tellurite sulfate","","","- Cu Ho2 O14 S2 Te2 -","- Cu Ho2 O14 S2 Te2 -","- Cu Ho2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0206","0.0204","","","0.0517","0.0519","","","","","","1.105","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001916","5.1661","0.0007","7.8092","0.001","8.0902","0.001","62.567","0.001","73.873","0.001","85.134","0.001","277.93","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Erbium copper tellurite sulfate","","","- Cu Er2 O14 S2 Te2 -","- Cu Er2 O14 S2 Te2 -","- Cu Er2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0141","0.014","","","0.0341","0.0342","","","","","","1.135","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001917","5.1529","0.0007","7.7976","0.0011","8.0821","0.0012","62.628","0.001","73.848","0.001","85.059","0.001","276.67","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Thulium copper tellurite sulfate","","","- Cu O14 S2 Te2 Tm2 -","- Cu O14 S2 Te2 Tm2 -","- Cu O14 S2 Te2 Tm2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0147","0.0147","","","0.0368","0.0369","","","","","","1.131","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001918","5.3283","0.0015","8.041","0.002","8.113","0.002","114.57","0.002","106.545","0.002","96.272","0.003","292.52","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Ytterbium copper tellurite sulfate","","","- Cu O14 S2 Te2 Yb2 -","- Cu O14 S2 Te2 Yb2 -","- Cu O14 S2 Te2 Yb2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.019","0.0188","","","0.0468","0.0469","","","","","","1.137","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001919","5.3269","0.0007","8.0617","0.001","8.1236","0.001","114.434","0.001","106.47","0.001","96.486","0.001","293.8","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Lutetium copper tellurite sulfate","","","- Cu Lu2 O14 S2 Te2 -","- Cu Lu2 O14 S2 Te2 -","- Cu Lu2 O14 S2 Te2 -","1","0.5","","Lin, Jian; Chai, Ping; Diefenbach, Kariem; Shatruk, Michael; Albrecht-Schmitt, Thomas E.","Challenges in the Search for Magnetic Coupling in 3d/4f Materials: Syntheses, Structures, and Magnetic Properties of the Lanthanide Copper Heterobimetallic Compounds, RE2Cu(TeO3)2(SO4)2","Chemistry of Materials","2014","26","6","2187","","10.1021/cm500252q","","","0.71073","MoKα","","0.0182","0.0176","","","0.0446","0.0449","","","","","","1.157","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001920","7.269","0.005","6.361","0.004","12.408","0.008","90","","106.556","0.011","90","","549.9","0.6","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- Ga4 S7 Sn -","- Ga4 S7 Sn -","- Ga8 S14 Sn2 -","2","1","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Cui, Hong-Hua; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","SHG Materials SnGa4Q7(Q = S, Se) Appearing with Large Conversion Efficiencies, High Damage Thresholds, and Wide Transparencies in the Mid-Infrared Region","Chemistry of Materials","2014","26","8","2743","","10.1021/cm5006955","","","0.71073","MoKα","","0.0203","0.0196","","","0.0418","0.0419","","","","","","0.979","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001921","7.577","0.004","6.666","0.003","13.023","0.008","90","","106.68","0.007","90","","630.1","0.6","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- Ga4 Se7 Sn -","- Ga4 Se7 Sn -","- Ga8 Se14 Sn2 -","2","1","","Luo, Zhong-Zhen; Lin, Chen-Sheng; Cui, Hong-Hua; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan","SHG Materials SnGa4Q7(Q = S, Se) Appearing with Large Conversion Efficiencies, High Damage Thresholds, and Wide Transparencies in the Mid-Infrared Region","Chemistry of Materials","2014","26","8","2743","","10.1021/cm5006955","","","0.71073","MoKα","","0.0562","0.0489","","","0.1099","0.1158","","","","","","1.032","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001922","13.271","0.004","13.303","0.004","14.211","0.004","67.296","0.006","87.59","0.006","76.695","0.006","2249.3","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H50 Mn2 N4 O29 Sr2 -","- C20 H50 Mn2 N4 O29 Sr2 -","- C40 H100 Mn4 N8 O58 Sr4 -","2","1","","González-Jiménez, Irma N.; Torres-Pardo, Almudena; Sánchez-Peláez, Ana E.; Gutiérrez, Ángel; García-Hernández, Mar; González-Calbet, José M.; Parras, Marina; Varela, Áurea","Synthesis of 4H-SrMnO3.0Nanoparticles from a Molecular Precursor and Their Topotactic Reduction Pathway Identified at Atomic Scale","Chemistry of Materials","2014","26","7","2256","","10.1021/cm500068y","","","0.71073","MoKα","","0.1459","0.0561","","","0.1169","0.1334","","","","","","0.734","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001923","13.605","0.003","3.8884","0.0008","17.594","0.004","90","","93.47","0.03","90","","929","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ca2.24 Nd7.76 O10 Sb2.97 -","- Ca2.234 Nd7.766 O10 Sb2.964 -","- Ca4.468 Nd15.532 O20 Sb5.928 -","2","0.25","","Forbes, Scott; Yuan, Fang; Saparov, Bayrammurad; Sefat, Athena S.; Kosuda, Kosuke; Kolodiazhnyi, Taras; Mozharivskyj, Yurij","Synthesis, Crystal Structure, and Electronic Properties of the CaRE3SbO4and Ca2RE8Sb3O10phases (RE = Rare-Earth Metal)","Chemistry of Materials","2014","26","7","2289","","10.1021/cm500157y","","","0.71073","MoKα","","0.054","0.0367","","","0.0556","0.059","","","","","","1.064","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001924","13.462","0.003","3.8429","0.0008","17.458","0.004","90","","93.62","0.03","90","","901.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ca2.12 O10 Sb2.99 Sm7.88 -","- Ca2.114 O10 Sb2.988 Sm7.886 -","- Ca4.228 O20 Sb5.976 Sm15.772 -","2","0.25","","Forbes, Scott; Yuan, Fang; Saparov, Bayrammurad; Sefat, Athena S.; Kosuda, Kosuke; Kolodiazhnyi, Taras; Mozharivskyj, Yurij","Synthesis, Crystal Structure, and Electronic Properties of the CaRE3SbO4and Ca2RE8Sb3O10phases (RE = Rare-Earth Metal)","Chemistry of Materials","2014","26","7","2289","","10.1021/cm500157y","","","0.71073","MoKα","","0.074","0.038","","","0.0423","0.0475","","","","","","0.954","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001925","13.651","0.003","3.9229","0.0008","17.628","0.004","90","","93.54","0.03","90","","942.2","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ca2.04 O10 Pr7.96 Sb2.97 -","- Ca2.034 O10 Pr7.966 Sb2.964 -","- Ca4.068 O20 Pr15.932 Sb5.928 -","2","0.25","","Forbes, Scott; Yuan, Fang; Saparov, Bayrammurad; Sefat, Athena S.; Kosuda, Kosuke; Kolodiazhnyi, Taras; Mozharivskyj, Yurij","Synthesis, Crystal Structure, and Electronic Properties of the CaRE3SbO4and Ca2RE8Sb3O10phases (RE = Rare-Earth Metal)","Chemistry of Materials","2014","26","7","2289","","10.1021/cm500157y","","","0.71073","MoKα","","0.0881","0.0356","","","0.0339","0.0395","","","","","","0.802","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001926","13.307","0.003","3.7791","0.0008","17.271","0.004","90","","93.67","0.03","90","","866.8","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ca1.9 O10 Sb3.02 Tb8.1 -","- Ca1.906 O10 Sb3.016 Tb8.094 -","- Ca3.812 O20 Sb6.032 Tb16.188 -","2","0.25","","Forbes, Scott; Yuan, Fang; Saparov, Bayrammurad; Sefat, Athena S.; Kosuda, Kosuke; Kolodiazhnyi, Taras; Mozharivskyj, Yurij","Synthesis, Crystal Structure, and Electronic Properties of the CaRE3SbO4and Ca2RE8Sb3O10phases (RE = Rare-Earth Metal)","Chemistry of Materials","2014","26","7","2289","","10.1021/cm500157y","","","0.71073","MoKα","","0.068","0.0344","","","0.0379","0.042","","","","","","0.936","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001927","13.386","0.003","3.7985","0.0008","17.368","0.004","90","","93.59","0.03","90","","881.4","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ca2.08 Gd7.92 O10 Sb2.97 -","- Ca2.082 Gd7.918 O10 Sb2.968 -","- Ca4.164 Gd15.836 O20 Sb5.936 -","2","0.25","","Forbes, Scott; Yuan, Fang; Saparov, Bayrammurad; Sefat, Athena S.; Kosuda, Kosuke; Kolodiazhnyi, Taras; Mozharivskyj, Yurij","Synthesis, Crystal Structure, and Electronic Properties of the CaRE3SbO4and Ca2RE8Sb3O10phases (RE = Rare-Earth Metal)","Chemistry of Materials","2014","26","7","2289","","10.1021/cm500157y","","","0.71073","MoKα","","0.0772","0.0404","","","0.0533","0.059","","","","","","1.007","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001928","8.9654","0.0002","8.9654","0.0002","8.9654","0.0002","90","","90","","90","","720.62","0.03","296","2","296","2","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Co2 Zn11 -","- Co2 Zn11 -","- Co8 Zn44 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0166","0.0165","","","0.0366","0.0366","","","","","","1.221","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001929","8.9552","0.0005","8.9552","0.0005","8.9552","0.0005","90","","90","","90","","718.17","0.07","296","2","296","2","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Co2.34 Zn10.63 -","- Co2.33 Zn10.642 -","- Co9.32 Zn42.568 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0154","0.0153","","","0.0341","0.0341","","","","","","1.226","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001930","8.911","0.003","8.911","0.003","8.911","0.003","90","","90","","90","","707.6","0.4","296","2","296","2","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Co2.65 Zn10.29 -","- Co2.66 Zn10.286 -","- Co10.64 Zn41.144 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0153","0.0139","","","0.0291","0.0297","","","","","","1.093","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001931","8.882","0.004","8.882","0.004","8.882","0.004","90","","90","","90","","700.7","0.5","273","2","273","2","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Co2.85 Zn10.03 -","- Co2.84 Zn10.034 -","- Co11.36 Zn40.136 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0165","0.0162","","","0.0381","0.0381","","","","","","1.079","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001932","9.051","0.0007","9.051","0.0007","9.051","0.0007","90","","90","","90","","741.46","0.1","296","2","296","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- Co0.92 Pd1.08 Zn11 -","- Co0.926 Pd1.074 Zn11 -","- Co3.704 Pd4.296 Zn44 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0226","0.0216","","","0.0451","0.0457","","","","","","1.061","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001933","9.078","0.001","9.078","0.001","9.078","0.001","90","","90","","90","","748.12","0.14","293","2","293","2","","","","","","","","3","I -4 3 m","I -4 2 3","217","","","","- Co2.5 Pd2.5 Zn8 -","- Co2.51 Pd2.49 Zn8 -","- Co10.04 Pd9.96 Zn32 -","4","0.0833333","","Xie, Weiwei; Miller, Gordon J.","New Co‒Pd‒Zn γ-Brasses with Dilute Ferrimagnetism and Co2Zn11Revisited: Establishing the Synergism between Theory and Experiment","Chemistry of Materials","2014","26","8","2624","","10.1021/cm500078w","","","0.71073","MoKα","","0.0152","0.0152","","","0.0405","0.0405","","","","","","1.108","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001934","9.095377","0.000032","6.049344","0.000018","8.256195","0.000024","90","","103.404","0.00027","90","","441.89","0.002","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","NdBaInO4","","- Ba In Nd O4 -","- Ba In Nd O4 -","- Ba4 In4 Nd4 O16 -","4","1","","Fujii, Kotaro; Esaki, Yuichi; Omoto, Kazuki; Yashima, Masatomo; Hoshikawa, Akinori; Ishigaki, Toru; Hester, James R.","New Perovskite-Related Structure Family of Oxide-Ion Conducting Materials NdBaInO4","Chemistry of Materials","2014","26","8","2488","","10.1021/cm500776x","powder diffraction","neutron","","neutron","","0.02127","","","","","","","0.04392","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001935","11.4235","0.0016","11.4235","0.0016","13.445","0.003","90","","90","","90","","1754.5","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Ca Mg3 N4 Si -","- Ca Mg3 N4 Si -","- Ca16 Mg48 N64 Si16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0494","0.0403","","","0.1063","0.1096","","","","","","1.044","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001936","11.4951","0.0016","11.4951","0.0016","13.512","0.003","90","","90","","90","","1785.4","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Mg3 N4 Si Sr -","- Mg3 N4 Si Sr -","- Mg48 N64 Si16 Sr16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0483","0.0362","","","0.1024","0.1113","","","","","","1.088","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001937","11.5105","0.0004","11.5105","0.0004","13.5519","0.0004","90","","90","","90","","1795.51","0.1","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- Eu Mg3 N4 Si -","- Eu Mg3 N4 Si -","- Eu16 Mg48 N64 Si16 -","16","1","","Schmiechen, Sebastian; Schneider, Hajnalka; Wagatha, Peter; Hecht, Cora; Schmidt, Peter J.; Schnick, Wolfgang","Toward New Phosphors for Application in Illumination-Grade White pc-LEDs: The Nitridomagnesosilicates Ca[Mg3SiN4]:Ce3+, Sr[Mg3SiN4]:Eu2+, and Eu[Mg3SiN4]","Chemistry of Materials","2014","26","8","2712","","10.1021/cm500610v","","","0.71073","MoKα","","0.0185","0.0163","","","0.0392","0.0403","","","","","","1.013","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001938","17.6594","0.0004","15.9973","0.0004","11.2462","0.0003","90","","90","","90","","3177.08","0.14","133","2","133","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C34 H8 B F15 N3 O3 Re -","- C34 H8 B F15 N3 O3 Re -","- C136 H32 B4 F60 N12 O12 Re4 -","4","0.5","","Chu, Wing-Kin; Ko, Chi-Chiu; Chan, Kin-Cheung; Yiu, Shek-Man; Wong, Fu-Lung; Lee, Chun-Sing; Roy, V. A. L.","A Simple Design for Strongly Emissive Sky-Blue Phosphorescent Neutral Rhenium Complexes: Synthesis, Photophysics, and Electroluminescent Devices","Chemistry of Materials","2014","26","8","2544","","10.1021/cm4038654","","","0.7107","MoKα","","0.0236","0.0197","","","0.0475","0.0494","","","","","","1.069","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001939","17.2988","0.0015","18.119","0.0016","31.676","0.003","90","","90","","90","","9928.4","1.5","150","2","150","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C7 H7 In N3 O9.5 -","- C7 H7 In N3 O9.5 -","- C224 H224 In32 N96 O304 -","32","1","","Zhao, Xiang; Mao, Chengyu; Bu, Xianhui; Feng, Pingyun","Direct Observation of Two Types of Proton Conduction Tunnels Coexisting in a New Porous Indium‒Organic Framework","Chemistry of Materials","2014","26","8","2492","","10.1021/cm500473f","","","0.71073","MoKα","","0.0321","0.0239","","","0.0612","0.0651","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001940","7.5376","0.0007","7.5376","0.0007","7.6002","0.0012","90","","90","","90","","431.81","0.09","293","2","293","2","","","","","","","","4","P 42 m c","P 4c -2","105","","","","- Ca Mn O6 Ti2 -","- Ca Mn O6 Ti2 -","- Ca4 Mn4 O24 Ti8 -","4","0.5","","Aimi, Akihisa; Mori, Daisuke; Hiraki, Ko-ichi; Takahashi, Toshihiro; Shan, Yue Jin; Shirako, Yuichi; Zhou, Jianshi; Inaguma, Yoshiyuki","High-Pressure Synthesis ofA-Site Ordered Double Perovskite CaMnTi2O6and Ferroelectricity Driven by Coupling ofA-Site Ordering and the Second-Order Jahn‒Teller Effect","Chemistry of Materials","2014","26","8","2601","","10.1021/cm500016z","","","0.71073","MoKα","","0.0215","0.0197","","","","0.0703","","","","","","1.279","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001941","4.8116","0.0004","7.3828","0.0007","18.4439","0.0017","88.811","0.007","88.827","0.007","74.371","0.008","630.75","0.1","293.1","0.2","293.1","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H7 Br2 N O3 S -","- C10 H7 Br2 N O3 S -","- C20 H14 Br4 N2 O6 S2 -","2","1","","Warnan, Julien; Cabanetos, Clément; Bude, Romain; El Labban, Abdulrahman; Li, Liang; Beaujuge, Pierre M.","Electron-DeficientN-Alkyloyl Derivatives of Thieno[3,4-c]pyrrole-4,6-dione Yield Efficient Polymer Solar Cells with Open-Circuit Voltages > 1 V","Chemistry of Materials","2014","26","9","2829","","10.1021/cm5002303","","","0.7107","MoKα","","0.089988","0.05587","","","","0.146153","","","","","","1.036","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001942","31.818","0.008","13.992","0.003","19.34","0.005","90","","98.544","0.003","90","","8515","4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C83 H111 Eu2 N13 O21 -","- C58 H30 Eu2 N8 O16 -","- C232 H120 Eu8 N32 O64 -","4","0.5","","Sava Gallis, Dorina F.; Rohwer, Lauren E. S.; Rodriguez, Mark A.; Nenoff, Tina M.","Efficient Photoluminescence via Metal‒Ligand Alteration in a New MOFs Family","Chemistry of Materials","2014","26","9","2943","","10.1021/cm500700z","","","0.71073","MoKα","","0.0874","0.0625","","","0.1601","0.169","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001943","32.092","0.018","34.184","","34.184","0.019","90","","90","","90","","37501","3","193","2","193","2","","","","","","","","5","I b c a","-I 2b 2c","73","","","","- C153 H169 In6 N27 O63 -","- C108 H60 In6 N12 O48 -","- C864 H480 In48 N96 O384 -","8","0.5","","Sava Gallis, Dorina F.; Rohwer, Lauren E. S.; Rodriguez, Mark A.; Nenoff, Tina M.","Efficient Photoluminescence via Metal‒Ligand Alteration in a New MOFs Family","Chemistry of Materials","2014","26","9","2943","","10.1021/cm500700z","","","0.71073","MoKα","","0.129","0.0939","","","0.2569","0.2762","","","","","","1.05","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001944","8.1443","0.0003","8.1171","0.0003","11.7005","0.0005","90","","90","","90","","773.5","0.05","293","2","293","2","","","","","","","","3","P n c 2","P 2 -2bc","30","","","","- Ag I3 O8 -","- Ag I3 O8 -","- Ag4 I12 O32 -","4","1","","Xu, Xiang; Hu, Chun-Li; Li, Bing-Xuan; Yang, Bing-Ping; Mao, Jiang-Gao","α-AgI3O8and β-AgI3O8with Large SHG Responses: Polymerization of IO3Groups into the I3O8Polyiodate Anion","Chemistry of Materials","2014","26","10","3219","","10.1021/cm500898q","","","0.71073","MoKα","","0.0226","0.0206","","","0.0455","0.0469","","","","","","1.028","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001945","8.1283","0.0001","8.1283","0.0001","23.4603","0.0007","90","","90","","90","","1550","0.05","293","2","293","2","","","","","","","","3","I -4","I -4","82","","","","- Ag I3 O8 -","- Ag I3 O8 -","- Ag8 I24 O64 -","8","1","","Xu, Xiang; Hu, Chun-Li; Li, Bing-Xuan; Yang, Bing-Ping; Mao, Jiang-Gao","α-AgI3O8and β-AgI3O8with Large SHG Responses: Polymerization of IO3Groups into the I3O8Polyiodate Anion","Chemistry of Materials","2014","26","10","3219","","10.1021/cm500898q","","","0.71073","MoKα","","0.0206","0.0199","","","0.0392","0.0398","","","","","","1.031","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001956","12.6029","0.001","15.0179","0.0012","20.6246","0.0015","90","","90","","90","","3903.6","0.5","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H34 N4 Sn -","- C16 H34 N4 Sn -","- C128 H272 N32 Sn8 -","8","1","","Kim, Sang Bok; Sinsermsuksakul, Prasert; Hock, Adam S.; Pike, Robert D.; Gordon, Roy G.","Synthesis of N-Heterocyclic Stannylene (Sn(II)) and Germylene (Ge(II)) and a Sn(II) Amidinate and Their Application as Precursors for Atomic Layer Deposition","Chemistry of Materials","2014","26","10","3065","","10.1021/cm403901y","","","0.71073","MoKα","","0.039","0.0266","","","0.0549","0.0598","","","","","","1.001","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001957","23.3846","0.0011","6.4294","0.0003","21.7442","0.001","90","","117.556","0.001","90","","2898.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 N2 Sn -","- C12 H26 N2 Sn -","- C96 H208 N16 Sn8 -","8","2","","Kim, Sang Bok; Sinsermsuksakul, Prasert; Hock, Adam S.; Pike, Robert D.; Gordon, Roy G.","Synthesis of N-Heterocyclic Stannylene (Sn(II)) and Germylene (Ge(II)) and a Sn(II) Amidinate and Their Application as Precursors for Atomic Layer Deposition","Chemistry of Materials","2014","26","10","3065","","10.1021/cm403901y","","","0.71073","MoKα","","0.0701","0.0644","","","0.1709","0.1733","","","","","","1.292","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001958","16.3608","0.0006","16.3608","0.0006","16.3608","0.0006","90","","90","","90","","4379.4","0.3","173","2","173","2","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- B4 Ca53 H23 In13 -","- B2.32 Ca52.668 H24.68 In13 -","- B4.64 Ca105.336 H49.36 In26 -","2","0.0416667","","Blankenship, Trevor V.; Chen, Banghao; Latturner, Susan E.","Ca54In13B4‒xH23+x: A Complex Metal Subhydride Featuring Ionic and Metallic Regions","Chemistry of Materials","2014","26","10","3202","","10.1021/cm5007982","","","0.71073","MoKα","","0.0171","0.0164","","","0.0415","0.0417","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001959","16.3608","0.0006","16.3608","0.0006","16.3608","0.0006","90","","90","","90","","4379.4","0.3","173","2","173","2","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- B4 Ca53 H23 In13 -","- B1.64 Ca52.68 H25.36 In13 -","- B3.28 Ca105.36 H50.72 In26 -","2","0.0416667","","Blankenship, Trevor V.; Chen, Banghao; Latturner, Susan E.","Ca54In13B4–xH23+x: A Complex Metal Subhydride Featuring Ionic and Metallic Regions","Chemistry of Materials","2014","26","10","3202","","10.1021/cm5007982","","","0.71073","MoKα","","0.0171","0.0165","","","0.0395","0.0397","","","","","","1.142","","","","has coordinates","281946","2023-03-20","09:26:09",""
"4001972","13.581","0.0015","9.9251","0.001","10.0151","0.0008","90","","90","","90","","1350","0.2","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.42 Gd1.33 Mn0.92 -","- Au3.406 Gd1.33333 Mn0.927333 -","- Au40.872 Gd16 Mn11.128 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0488","0.0326","","","0.0663","0.0734","","","","","","0.996","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001973","13.5713","0.0007","9.9291","0.0004","10.0213","0.0005","90","","90","","90","","1350.38","0.11","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.42 Gd1.33 Mn0.91 -","- Au3.42467 Gd1.33333 Mn0.908667 -","- Au41.096 Gd16 Mn10.904 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0573","0.0343","","","0.0692","0.0751","","","","","","0.982","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001974","13.5583","0.0019","9.9263","0.0011","10.0519","0.0013","90","","90","","90","","1352.8","0.3","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.54 Gd1.33 Mn0.79 -","- Au3.542 Gd1.33333 Mn0.791333 -","- Au42.504 Gd16 Mn9.496 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0391","0.0317","","","0.0724","0.0758","","","","","","1.019","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001975","13.5024","0.0009","9.9189","0.0007","10.0646","0.0005","90","","90","","90","","1347.94","0.15","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.67 Gd1.33 Mn0.67 -","- Au3.65867 Gd1.33333 Mn0.674667 -","- Au43.904 Gd16 Mn8.096 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0577","0.0361","","","0.0638","0.0698","","","","","","1.01","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001976","13.4944","0.0019","9.9103","0.0013","9.9644","0.0013","90","","90","","90","","1332.6","0.3","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.42 Mn0.92 Y1.33 -","- Au3.39867 Mn0.934667 Y1.33333 -","- Au40.784 Mn11.216 Y16 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0788","0.0517","","","0.104","0.1169","","","","","","1.02","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001977","13.484","0.003","9.908","0.003","9.971","0.003","90","","90","","90","","1332.1","0.6","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.44 Mn0.89 Y1.33 -","- Au3.444 Mn0.889333 Y1.33333 -","- Au41.328 Mn10.672 Y16 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0853","0.0645","","","0.1351","0.1177","","","","","","1.03","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001978","13.4774","0.0009","9.8922","0.0008","9.9814","0.0007","90","","90","","90","","1330.73","0.17","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au3.46 Mn0.88 Y1.33 -","- Au3.46267 Mn0.870667 Y1.33333 -","- Au41.552 Mn10.448 Y16 -","12","","","Samal, Saroj L.; Pandey, Abhishek; Johnston, David C.; Corbett, John D.; Miller, Gordon J.","Taking Advantage of Gold’s Electronegativity inR4Mn3‒xAu10+x(R= Gd or Y; 0.2 ≤x≤ 1)","Chemistry of Materials","2014","26","10","3209","","10.1021/cm500871c","","","0.71073","MoKα","","0.0702","0.0489","","","0.1151","0.1271","","","","","","1.007","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001979","11.16","0.0016","11.16","0.0016","12.865","0.003","90","","90","","90","","1602.3","0.5","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Clacium litho nitridoaluminate","Clacium litho nitridoaluminate","","- Al3 Ca Li N4 -","- Al3 Ca Li N4 -","- Al48 Ca16 Li16 N64 -","16","1","","Pust, Philipp; Wochnik, Angela S.; Baumann, Elen; Schmidt, Peter J.; Wiechert, Detlef; Scheu, Christina; Schnick, Wolfgang","Ca[LiAl3N4]:Eu2+—A Narrow-Band Red-Emitting Nitridolithoaluminate","Chemistry of Materials","2014","26","11","3544","","10.1021/cm501162n","","","0.71073","MoKα","","0.0341","0.0303","","","0.0762","0.0787","","","","","","1.072","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001985","14.638","0.002","19.642","0.003","20.303","0.003","90","","90","","90","","5837.5","1.5","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H27 Al N4 O3 -","- C36 H27 Al N4 O3 -","- C288 H216 Al8 N32 O24 -","8","1","","Lin, Na; Qiao, Juan; Duan, Lian; Xue, Jie; Wang, Liduo","Rational Design of Chelated Aluminum Complexes toward Highly Efficient and Thermally Stable Electron-Transporting Materials","Chemistry of Materials","2014","26","12","3693","","10.1021/cm5011604","","","","","","0.069","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001986","10.432","0.002","11.273","0.002","15.005","0.003","109.99","0.03","90.72","0.03","97.22","0.03","1642.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H27 Al N5 O3 -","- C41 H30 Al N5 O3 -","- C82 H60 Al2 N10 O6 -","2","1","","Lin, Na; Qiao, Juan; Duan, Lian; Xue, Jie; Wang, Liduo","Rational Design of Chelated Aluminum Complexes toward Highly Efficient and Thermally Stable Electron-Transporting Materials","Chemistry of Materials","2014","26","12","3693","","10.1021/cm5011604","","","0.71073","MoKα","","0.0952","0.0742","","","0.1937","0.2106","","","","","","1.06","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001987","8.0778","0.0001","8.0778","0.0001","8.0778","0.0001","90","","90","","90","","527.083","0.011","293","2","293","2","","","","","","","","4","I -4 3 m","I -4 2 3","217","","","","- F6 Ni3 O6 Sb4 -","- F6 Ni3 O6 Sb4 -","- F12 Ni6 O12 Sb8 -","2","0.0416667","","Hu, Shichao; Johnsson, Mats; Lemmens, Peter; Schmid, Daniel; Menzel, Dirk; Tapp, Joshua; Möller, Angela","Acentric Pseudo-Kagome Structures: The Solid Solution (Co1‒xNix)3Sb4O6F6","Chemistry of Materials","2014","26","12","3631","","10.1021/cm500339z","","","0.71073","MoKα","","0.0103","0.0098","","","0.0246","0.0247","","","","","","1.347","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001988","8.176","0.001","8.176","0.001","8.176","0.001","90","","90","","90","","546.54","0.12","293","2","293","2","","","","","","","","4","I -4 3 m","I -4 2 3","217","","","","- Co3 F6 O6 Sb4 -","- Co3 F6 O6 Sb4 -","- Co6 F12 O12 Sb8 -","2","0.0416667","","Hu, Shichao; Johnsson, Mats; Lemmens, Peter; Schmid, Daniel; Menzel, Dirk; Tapp, Joshua; Möller, Angela","Acentric Pseudo-Kagome Structures: The Solid Solution (Co1‒xNix)3Sb4O6F6","Chemistry of Materials","2014","26","12","3631","","10.1021/cm500339z","","","0.71073","MoKα","","0.0148","0.0148","","","0.038","0.038","","","","","","1.065","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001989","4.0216","0.0002","4.0216","0.0002","10.1798","0.0005","90","","90","","90","","164.641","0.014","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.78 Pr -","- As2 Co1.782 Pr -","- As4 Co3.564 Pr2 -","2","0.0625","","Thompson, Corey M.; Tan, Xiaoyan; Kovnir, Kirill; Garlea, V. Ovidiu; Gippius, Andrei A.; Yaroslavtsev, Alexander A.; Menushenkov, Alexey P.; Chernikov, Roman V.; Büttgen, Norbert; Krätschmer, Wolfgang; Zubavichus, Yan V.; Shatruk, Michael","Synthesis, Structures, and Magnetic Properties of Rare-Earth Cobalt Arsenides, RCo2As2(R = La, Ce, Pr, Nd)","Chemistry of Materials","2014","26","12","3825","","10.1021/cm501522v","","","0.71073","MoKα","","0.0207","0.0201","","","0.0518","0.052","","","","","","1.585","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001990","4.0494","0.0003","4.0494","0.0003","10.4987","0.0008","90","","90","","90","","172.15","0.02","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- As2 Bi0.03 Co1.91 La0.97 -","- As2 Bi0.032 Co1.916 La0.969 -","- As4 Bi0.064 Co3.832 La1.938 -","2","0.0625","","Thompson, Corey M.; Tan, Xiaoyan; Kovnir, Kirill; Garlea, V. Ovidiu; Gippius, Andrei A.; Yaroslavtsev, Alexander A.; Menushenkov, Alexey P.; Chernikov, Roman V.; Büttgen, Norbert; Krätschmer, Wolfgang; Zubavichus, Yan V.; Shatruk, Michael","Synthesis, Structures, and Magnetic Properties of Rare-Earth Cobalt Arsenides, RCo2As2(R = La, Ce, Pr, Nd)","Chemistry of Materials","2014","26","12","3825","","10.1021/cm501522v","","","0.71073","MoKα","","0.0201","0.0193","","","0.045","0.0456","","","","","","1.229","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001991","4.0309","0.0001","4.0309","0.0001","10.2591","0.0004","90","","90","","90","","166.691","0.009","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- As2 Bi0.05 Ce0.95 Co1.83 -","- As2 Bi0.042 Ce0.959 Co1.828 -","- As4 Bi0.084 Ce1.918 Co3.656 -","2","0.0625","","Thompson, Corey M.; Tan, Xiaoyan; Kovnir, Kirill; Garlea, V. Ovidiu; Gippius, Andrei A.; Yaroslavtsev, Alexander A.; Menushenkov, Alexey P.; Chernikov, Roman V.; Büttgen, Norbert; Krätschmer, Wolfgang; Zubavichus, Yan V.; Shatruk, Michael","Synthesis, Structures, and Magnetic Properties of Rare-Earth Cobalt Arsenides, RCo2As2(R = La, Ce, Pr, Nd)","Chemistry of Materials","2014","26","12","3825","","10.1021/cm501522v","","","0.71073","MoKα","","0.0197","0.0179","","","0.0405","0.041","","","","","","1.181","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001992","21.231","0.004","23.026","0.005","24.026","0.005","90","","94.949","0.004","90","","11702","4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C98 H114 Cu3 N30 O34 P6 -","- C98 H90 Cu3 N30 O34 P6 -","- C392 H360 Cu12 N120 O136 P24 -","4","0.5","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","0.71073","MoKα","","0.2151","0.093","","","0.2278","0.2868","","","","","","1.031","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001993","10.3","0.006","6.107","0.004","22.774","0.013","90","","93.104","0.012","90","","1430.4","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 N4 O P -","- C16 H15 N4 O P -","- C64 H60 N16 O4 P4 -","4","1","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","0.71073","MoKα","","0.1058","0.0697","","","0.167","0.188","","","","","","1.099","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001994","20.399","0.0018","20.399","0.0018","24.969","0.002","90","","90","","120","","8998.1","1.3","100","2","100","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C96 H118 Cl5 Cu3 N25 O43 P6 -","- C96 H90 Cl5 Cu3 N25 O42.9998 P6 -","- C288 H270 Cl15 Cu9 N75 O128.999 P18 -","3","0.333333","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","0.71073","MoKα","","0.1007","0.0607","","","0.1339","0.1543","","","","","","1.012","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001995","20.8422","0.0011","23.7059","0.0012","38.839","0.002","90","","103.819","0.003","90","","18634.3","1.7","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C144 H163 Cu4 N44 O47 P9 -","- C144 H135 Cu4 N41 O28 P9 -","- C576 H540 Cu16 N164 O112 P36 -","4","1","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","1.54178","CuKα","","0.1994","0.1434","","","0.4063","0.4299","","","","","","1.375","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001996","21.364","0.003","22.855","0.003","33.322","0.005","90","","91.641","0.003","90","","16264","4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C128 H148 Cu4 N40 O46 P8 -","- C128 H120 Cu4 N38 O36.5 P8 -","- C512 H480 Cu16 N152 O146 P32 -","4","1","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","0.71073","MoKα","","0.258","0.1156","","","0.3109","0.3633","","","","","","0.933","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001997","20.565","0.002","20.565","0.002","50.106","0.004","90","","90","","120","","18352","3","100","2","100","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C65 H78 Cl4 Cu2 N16 O28 P4 -","- C65 H64 Cl4 Cu2 N16 O28 P4 -","- C585 H576 Cl36 Cu18 N144 O252 P36 -","9","1","","Srivastava, Anant Kumar; Praveenkumar, B.; Mahawar, Indra Kumar; Divya, Pillutla; Shalini, S.; Boomishankar, Ramamoorthy","Anion Driven [CuIIL2]nFrameworks: Crystal Structures, Guest-Encapsulation, Dielectric, and Possible Ferroelectric Properties","Chemistry of Materials","2014","26","12","3811","","10.1021/cm5014575","","","0.71073","MoKα","","0.0641","0.0594","","","0.1611","0.1673","","","","","","1.026","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4002013","13.7195","0.0001","35.2245","0.0006","22.1362","0.0001","90","","90","","90","","10697.6","0.2","","","295","","","","","","","","","5","F m m 2","F 2 -2","42","SSZ-45","","","- C88 H168 N16 O400 Si200 -","- C88 H168 N16 O400 Si200 -","- C88 H168 N16 O400 Si200 -","1","0.0625","","Smeets, Stef; Xie, Dan; McCusker, Lynne B.; Baerlocher, Christian; Zones, Stacey I.; Thompson, Joshua A.; Lacheen, Howard S.; Huang, Hua-Min","SSZ-45: A High-Silica Zeolite with Small Pore Openings, Large Cavities, and Unusual Adsorption Properties","Chemistry of Materials","2014","26","13","3909","3913","10.1021/cm501176j","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","288183","2023-12-08","14:42:53",""
"4002014","41.604","0.006","41.604","0.006","40.246","0.005","90","","90","","120","","60329","14","193","2","193","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C93 H106 Eu In N6 O22 -","- C63 H35 Eu In O16 -","- C1134 H630 Eu18 In18 O288 -","18","1","","Sava Gallis, Dorina F.; Rohwer, Lauren E. S.; Rodriguez, Mark A.; Nenoff, Tina M.","Correction to Efficient Photoluminescence via Metal‒Ligand Alteration in a New MOFs Family","Chemistry of Materials","2014","26","13","4044","","10.1021/cm5019376","","","0.71073","MoKα","","0.1639","0.1173","","","0.3182","0.3508","","","","","","1.145","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002015","18.917","0.002","5.0175","0.0006","17.6728","0.0019","90","","95.137","0.006","90","","1670.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 N2 O2 S2 -","- C42 H42 N2 O2 S2 -","- C84 H84 N4 O4 S4 -","2","0.5","","He, Bo; Pun, Andrew B.; Klivansky, Liana M.; McGough, Alexandra M.; Ye, Yifan; Zhu, Junfa; Guo, Jinghua; Teat, Simon J.; Liu, Yi","Thiophene Fused Azacoronenes: Regioselective Synthesis, Self-Organization, Charge Transport and Its Incorporation in Conjugated Polymers","Chemistry of Materials","2014","26","13","3920","","10.1021/cm5018272","","","0.7749","synchrotron","","0.0673","0.055","","","0.1429","0.1529","","","","","","1.043","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4002021","12.5776","0.0004","19.7185","0.0008","13.8892","0.0005","90","","93.471","0.001","90","","3438.4","0.2","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H31 N14 O7 Tb W -","- C26 H31 N14 O7 Tb W -","- C104 H124 N56 O28 Tb4 W4 -","4","1","","Chorazy, Szymon; Nakabayashi, Koji; Ohkoshi, Shin-ichi; Sieklucka, Barbara","Green to Red Luminescence Switchable by Excitation Light in Cyanido-Bridged TbIII‒WVFerromagnet","Chemistry of Materials","2014","26","14","4072","","10.1021/cm501954e","","","0.71075","MoKα","","0.0829","0.0484","","","0.0864","0.097","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002022","9.5928","0.0002","21.3991","0.0005","5.8889","0.0002","90","","90","","90","","1208.86","0.06","299","2","299","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- Al7 Ba4.75 Eu0.25 N25 Si11 -","- Al7.0002 Ba4.75 Eu0.25 N25 Si10.9998 -","- Al14.0004 Ba9.5 Eu0.5 N50 Si21.9996 -","2","0.25","","Hirosaki, Naoto; Takeda, Takashi; Funahashi, Shiro; Xie, Rong-Jun","Discovery of New Nitridosilicate Phosphors for Solid State Lighting by the Single-Particle-Diagnosis Approach","Chemistry of Materials","2014","26","14","4280","","10.1021/cm501866x","","","0.71073","MoKα","","0.0353","0.0244","","","","0.0535","","","","","","1.052","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002023","5.8465","0.0004","26.7255","0.0018","5.8386","0.0004","90","","118.897","0.001","90","","798.7","0.09","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Al3 Ba0.84 Eu0.16 N9 Si4 -","- Al3.0006 Ba0.841 Eu0.159 N9 Si4.0004 -","- Al12.0024 Ba3.364 Eu0.636 N36 Si16.0016 -","4","1","","Hirosaki, Naoto; Takeda, Takashi; Funahashi, Shiro; Xie, Rong-Jun","Discovery of New Nitridosilicate Phosphors for Solid State Lighting by the Single-Particle-Diagnosis Approach","Chemistry of Materials","2014","26","14","4280","","10.1021/cm501866x","","","0.71073","MoKα","","0.035","0.0253","","","","0.0681","","","","","","1.06","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002024","9.20688","0.00009","9.10175","0.00009","13.7119","0.00016","90","","90","","90","","1149.04","0.02","298","","298","","","","","","","","","4","P b c a","-P 2ac 2ab","61","orthorhombic lithium cobalt sulfate","orthorhombic lithium cobalt sulfate","","- Co Li2 O8 S2 -","- Co Li2 O8 S2 -","- Co8 Li16 O64 S16 -","8","1","","Lander, Laura; Reynaud, Marine; Rousse, Gwenaëlle; Sougrati, Moulay T.; Laberty-Robert, Christel; Messinger, Robert J.; Deschamps, Michaël; Tarascon, Jean-Marie","Synthesis and Electrochemical Performance of the Orthorhombic Li2Fe(SO4)2Polymorph for Li-Ion Batteries","Chemistry of Materials","2014","26","14","4178","","10.1021/cm5012845","powder diffraction","","1.78901","CoKα","","","","","","","","","1.9868","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002025","9.348","0.003","23.74","0.007","11.388","0.004","90","","104.51","0.006","90","","2446.6","1.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 O -","- C33 H24 O -","- C132 H96 O4 -","4","1","","Ma, Ji; Lin, Tingting; Pan, Xiaoyong; Wang, Weizhi","Graphene-like Molecules Based on Tetraphenylethene Oligomers: Synthesis, Characterization, and Applications","Chemistry of Materials","2014","26","14","4221","4229","10.1021/cm501590w","","","0.71073","MoKα","","0.0886","0.0554","","","0.1268","0.1466","","","","","","1.082","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002026","42.75","0.02","5.584","0.003","24.009","0.013","90","","107.239","0.01","90","","5474","5","296","2","296","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C66 H48 -","- C66 H48 -","- C264 H192 -","4","0.5","","Ma, Ji; Lin, Tingting; Pan, Xiaoyong; Wang, Weizhi","Graphene-like Molecules Based on Tetraphenylethene Oligomers: Synthesis, Characterization, and Applications","Chemistry of Materials","2014","26","14","4221","","10.1021/cm501590w","","","0.71073","MoKα","","0.1546","0.0578","","","0.1121","0.1317","","","","","","1.009","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002027","8.9848","0.0009","10.0585","0.001","13.0237","0.0013","82.866","0.002","75.195","0.002","78.641","0.002","1112.24","0.19","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","1-(4-(1,2-bis(methoxycarbonyl)phen-5-oxy)butyl) -3-methylimidazolium hexa-fluorophosphate","","- C18 H23 F6 N2 O5 P -","- C18 H23 F6 N2 O5 P -","- C36 H46 F12 N4 O10 P2 -","2","1","","Brandel, Clément; Gbabode, Gabin; Cartigny, Yohann; Martin, Claudette; Gouhier, Géraldine; Petit, Samuel; Coquerel, Gérard","Crystal Growth, Structure, and Polymorphic Behavior of an Ionic Liquid: Phthalate Derivative ofN-Butyl,N-methylimidazolium Hexafluorophosphate","Chemistry of Materials","2014","26","14","4151","","10.1021/cm501220x","","x-ray","0.71073","MoKα","","0.0836","0.0645","","","0.1522","0.1649","","","","","","1.087","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4002028","41.199","0.004","41.199","0.004","5.776","0.0005","90","","90","","90","","9803.9","1.6","298","2","298","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- C34 H24 -","- C34 H24 -","- C544 H384 -","16","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.1109","0.0481","","","0.1062","0.1342","","","","","","1.008","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002029","13.7789","0.0017","9.4646","0.0012","19.552","0.003","90","","109.107","0.002","90","","2409.3","0.6","296","2","296","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 -","- C34 H24 -","- C136 H96 -","4","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.0745","0.0582","","","0.1536","0.1751","","","","","","1.059","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002030","9.7985","0.0014","11.7195","0.0017","13.649","0.002","87.418","0.002","69.712","0.002","79.112","0.002","1443.3","0.4","298","2","298","2","","","","","","","","2","P -1","-P 1","2","","","","- C42 H28 -","- C42 H28 -","- C84 H56 -","2","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.0607","0.047","","","0.1496","0.1777","","","","","","1.034","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002031","9.6966","0.0008","11.6563","0.0009","13.4072","0.001","87.669","0.001","70.561","0.001","79.684","0.001","1405.6","0.19","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","","","- C42 H28 -","- C42 H28 -","- C84 H56 -","2","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.0545","0.046","","","0.1324","0.1438","","","","","","1.064","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002032","11.1338","0.0017","11.7377","0.0018","13.64","0.002","99.497","0.002","106.951","0.002","114.788","0.002","1460.9","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C42.5 H29 Cl -","- C42.5 H29 Cl -","- C85 H58 Cl2 -","2","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.0646","0.0596","","","0.1857","0.1906","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4002033","11.171","0.003","11.66","0.003","13.685","0.004","99.793","0.004","107.008","0.003","114.141","0.004","1467.3","0.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C43 H32 O -","- C43 H32 O -","- C86 H64 O2 -","2","1","","Zhang, Guo-Feng; Wang, Hongfeng; Aldred, Matthew P.; Chen, Tao; Chen, Ze-Qiang; Meng, Xianggao; Zhu, Ming-Qiang","General Synthetic Approach toward Geminal-Substituted Tetraarylethene Fluorophores with Tunable Emission Properties: X-ray Crystallography, Aggregation-Induced Emission and Piezofluorochromism","Chemistry of Materials","2014","26","15","4433","","10.1021/cm501414b","","","0.71073","MoKα","","0.0821","0.0557","","","0.1503","0.1698","","","","","","1.031","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4002034","8.56294","0.00008","8.56294","0.00008","22.7703","0.0003","90","","90","","90","","1669.61","0.03","99.99","0.1","99.97","0.11","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- H22 N4 O3 S6 Sn2 -","- H22 N4 O3 S6 Sn2 -","- H88 N16 O12 S24 Sn8 -","4","0.5","","Nørby, Peter; Overgaard, Jacob; Christensen, Per S.; Richter, Bo; Song, Xin; Dong, Mingdong; Han, Anpan; Skibsted, Jørgen; Iversen, Bo B.; Johnsen, Simon","(NH4)4Sn2S6·3H2O: Crystal Structure, Thermal Decomposition, and Precursor for Textured Thin Film","Chemistry of Materials","2014","26","15","4494","","10.1021/cm501681r","","","0.71073","MoKα","","0.0185","0.0162","","","0.0313","0.0322","","","","","","1.077","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002035","8.067","0.008","23.1","0.02","4.34","0.004","90","","90","","90","","808.7","1.3","110","2","110","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C12 F6 I4 -","- C12 F6 I4 -","- C24 F12 I8 -","2","0.5","","Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai","Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area","Chemistry of Materials","2014","26","15","4589","","10.1021/cm501922h","","","0.71073","MoKα","","0.027","0.0261","","","0.0706","0.0712","","","","","","1.161","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002036","16.691","0.011","7.314","0.005","11.161","0.007","90","","111.11","0.006","90","","1271.1","1.4","110","2","110","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H6 Br4 -","- C12 H6 Br4 -","- C48 H24 Br16 -","4","0.5","","Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai","Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area","Chemistry of Materials","2014","26","15","4589","","10.1021/cm501922h","","","0.71073","MoKα","","0.0352","0.0289","","","0.0669","0.0687","","","","","","1.075","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002037","13.334","0.003","20.948","0.004","15.971","0.003","90","","114.402","0.002","90","","4062.5","1.4","110","2","110","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 I4 -","- C18 H18 I4 -","- C144 H144 I32 -","8","2","","Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai","Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area","Chemistry of Materials","2014","26","15","4589","","10.1021/cm501922h","","","0.71073","MoKα","","0.0342","0.0247","","","0.0467","0.0494","","","","","","1.046","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002038","13.044","0.005","6.284","0.003","12.147","0.006","90","","108.793","0.007","90","","942.6","0.7","110","2","110","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H4 F6 -","- C12 H4 F6 -","- C48 H16 F24 -","4","0.5","","Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai","Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area","Chemistry of Materials","2014","26","15","4589","","10.1021/cm501922h","","","0.71073","MoKα","","0.0396","0.0336","","","0.0948","0.0974","","","","","","1.097","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002039","12.997","0.006","13.035","0.006","13.301","0.006","90","","91.472","0.005","90","","2252.7","1.8","110","2","110","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C18 H18 I4 O4 -","- C18 H18 I4 O4 -","- C72 H72 I16 O16 -","4","1","","Lu, Weigang; Wei, Zhangwen; Yuan, Daqiang; Tian, Jian; Fordham, Stephen; Zhou, Hong-Cai","Rational Design and Synthesis of Porous Polymer Networks: Toward High Surface Area","Chemistry of Materials","2014","26","15","4589","","10.1021/cm501922h","","","0.71073","MoKα","","0.0419","0.0399","","","0.0919","0.093","","","","","","1.057","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002040","9.8153","0.0003","10.5285","0.0004","13.4153","0.0005","70.642","0.001","69.211","0.001","65.595","0.001","1152.13","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-{(Z)-2-[(E)-3-(5-Dibutylamino-thiophene-2-yl)-allylidene]- 3-oxo-indan-1-ylidene}-malononitrile","","- C27 H27 N3 O S -","- C27 H27 N3 O S -","- C54 H54 N6 O2 S2 -","2","1","","Zitzler-Kunkel, André; Lenze, Martin R.; Kronenberg, Nils M.; Krause, Ana-Maria; Stolte, Matthias; Meerholz, Klaus; Würthner, Frank","NIR-Absorbing Merocyanine Dyes for BHJ Solar Cells","Chemistry of Materials","2014","26","16","4856","","10.1021/cm502302s","","","1.54178","CuKα","","0.0336","0.0313","","","0.0795","0.0811","","","","","","1.025","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002041","8.4959","0.0004","10.8732","0.0005","14.5478","0.0006","98.914","0.002","103.321","0.002","93.11","0.002","1286.27","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(Z)-1-Benzyl-5-[(E)-3-(5-dibutylamino-thiophene-2-yl)-allylidene]- 4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile","","- C29 H33 N3 O2 S -","- C29 H33 N3 O2 S -","- C58 H66 N6 O4 S2 -","2","1","","Zitzler-Kunkel, André; Lenze, Martin R.; Kronenberg, Nils M.; Krause, Ana-Maria; Stolte, Matthias; Meerholz, Klaus; Würthner, Frank","NIR-Absorbing Merocyanine Dyes for BHJ Solar Cells","Chemistry of Materials","2014","26","16","4856","","10.1021/cm502302s","","","1.54178","CuKα","","0.0366","0.0335","","","0.0884","0.0911","","","","","","1.05","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002042","8.1665","0.0012","11.646","0.0016","13.6587","0.0019","107.664","0.005","102.114","0.006","96.172","0.006","1189.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1-Benzyl-(5-dibutylamino-thiophene-2-yl-methylene)-4-methyl-2,6-dioxo- 1,2,5,6-tetrahydropyridine-3-carbonitrile","","- C27 H31 N3 O2 S -","- C27 H31 N3 O2 S -","- C54 H62 N6 O4 S2 -","2","1","","Zitzler-Kunkel, André; Lenze, Martin R.; Kronenberg, Nils M.; Krause, Ana-Maria; Stolte, Matthias; Meerholz, Klaus; Würthner, Frank","NIR-Absorbing Merocyanine Dyes for BHJ Solar Cells","Chemistry of Materials","2014","26","16","4856","","10.1021/cm502302s","","","1.54178","CuKα","","0.0408","0.0372","","","0.0994","0.1026","","","","","","1.046","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002043","26.2498","0.0004","26.2498","0.0004","26.2498","0.0004","90","","90","","90","","18087.5","0.5","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+cyclohexane","","","- C27 H25.32 Cu3 O12.66 -","- C27 H7.26 Cu3 O12.624 -","- C432 H116.16 Cu48 O201.984 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0563","0.0487","","","0.1878","0.1984","","","","","","1.237","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002044","26.3758","0.0013","26.3758","0.0013","26.3758","0.0013","90","","90","","90","","18349.2","1.6","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+THF","","","- C32 H20 Cu3 O15.5 -","- C30 H18 Cu3 O15.5 -","- C480 H288 Cu48 O248 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0567","0.0475","","","0.1977","0.2041","","","","","","1.39","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002045","26.3164","0.0008","26.3164","0.0008","26.3164","0.0008","90","","90","","90","","18225.5","1","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+1PrOH","","","- C28.5 H34 Cu3 O15.5 -","- C27.178 H6 Cu3 O15.5 -","- C434.848 H96 Cu48 O248 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0498","0.0384","","","0.1214","0.1347","","","","","","1.106","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4002046","26.3011","0.0005","26.3011","0.0005","26.3011","0.0005","90","","90","","90","","18193.7","0.6","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+toluene","","","- C28.5 H20.16 Cu3 O13.08 -","- C28.5 H8.16 Cu3 O13.068 -","- C456 H130.56 Cu48 O209.088 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.056","0.0448","","","0.1557","0.1684","","","","","","1.175","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002047","26.3238","0.0005","26.3238","0.0005","26.3238","0.0005","90","","90","","90","","18240.9","0.6","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+ethanol","","","- C28 H36 Cu3 O17 -","- C26.48 H6 Cu3 O16.248 -","- C423.68 H96 Cu48 O259.968 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.068","0.0532","","","0.155","0.1754","","","","","","1.099","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002048","26.3273","0.0006","26.3273","0.0006","26.3273","0.0006","90","","90","","90","","18248.2","0.7","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+MeOH","","","- C23 H26 Cu3 O17 -","- C23 H6 Cu3 O16.98 -","- C368 H96 Cu48 O271.68 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0434","0.0337","","","0.1016","0.1093","","","","","","1.127","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002049","26.2843","0.0017","26.2843","0.0017","26.2843","0.0017","90","","90","","90","","18159","2","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+hexane","","","- C19 H12.28 Cu3 O13.11 -","- C21 H8.28 Cu3 O13.131 -","- C336 H132.48 Cu48 O210.096 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0645","0.0528","","","0.1854","0.1985","","","","","","1.255","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002050","26.3048","0.0007","26.3048","0.0007","26.3048","0.0007","90","","90","","90","","18201.4","0.8","293","2","293","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+H2O","","","- C18 H7.5 Cu3 O12.75 -","- C18 H7.62 Cu3 O12.807 -","- C288 H121.92 Cu48 O204.912 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0425","0.0315","","","0.0861","0.0927","","","","","","1.119","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002051","26.3462","0.0005","26.3462","0.0005","26.3462","0.0005","90","","90","","90","","18287.5","0.6","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]+MeCN","","","- C24 H18 Cu3 N3 O13.5 -","- C23.98 H6 Cu3 N2.99 O13.467 -","- C383.68 H96 Cu48 N47.84 O215.472 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0538","0.0407","","","0.1252","0.1369","","","","","","1.17","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4002052","26.2711","0.0004","26.2711","0.0004","26.2711","0.0004","90","","90","","90","","18131.5","0.5","273","2","273","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","[Cu3(BTC)2]","","","- C18 H6 Cu3 O12 -","- C18 H6 Cu3 O12 -","- C288 H96 Cu48 O192 -","16","0.0833333","","Peterson, Vanessa K.; Southon, Peter D.; Halder, Gregory J.; Price, David J.; Bevitt, Joseph J.; Kepert, Cameron J.","Guest Adsorption in the Nanoporous Metal‒Organic Framework Cu3(1,3,5-Benzenetricarboxylate)2: CombinedIn SituX-ray Diffraction and Vapor Sorption","Chemistry of Materials","2014","26","16","4712","","10.1021/cm501138g","","","0.71073","MoKα","","0.0324","0.024","","","0.0612","0.0656","","","","","","1.123","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002053","18.945","0.004","18.945","0.004","27.561","0.01","90","","90","","90","","9892","5","293","2","293","2","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- C6.5 H5.5 Cu0.5 N0 O2.5 -","- C6.5 H6 Cu0.5 O2.5 -","- C208 H192 Cu16 O80 -","32","1","","Li, Liangjun; Bell, Jon G.; Tang, Sifu; Lv, Xiaoxia; Wang, Chao; Xing, Yanlong; Zhao, Xuebo; Thomas, K. Mark","Gas Storage and Diffusion through Nanocages and Windows in Porous Metal‒Organic Framework Cu2(2,3,5,6-tetramethylbenzene-1,4-diisophthalate)(H2O)2","Chemistry of Materials","2014","26","16","4679","","10.1021/cm403697m","","","0.71073","MoKα","","0.1421","0.0678","","","0.1452","0.1552","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002054","16.235","0.003","6.352","0.0013","12.077","0.002","90","","131.1","0.03","90","","938.5","0.5","293","2","293","2","","","","","","","synthesis as described","3","C 1 2/c 1","-C 2yc","15","","Molybdenum thiochloride","","- Cl6 Mo2 S2 -","- Cl6 Mo2 S2 -","- Cl24 Mo8 S8 -","4","0.5","","Islam, Saiful M.; Subrahmanyam, Kota S.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","One-Dimensional Molybdenum Thiochlorides and Their Use in High Surface Area MoSxChalcogels","Chemistry of Materials","2014","26","17","5151","","10.1021/cm5024579","","x-ray","0.71073","MoKα","","0.0606","0.045","","","0.0875","0.0921","","","","","","1.119","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002055","13.956","0.003","11.141","0.002","13.011","0.003","90","","90","","90","","2023","0.7","293","2","293","2","","","","","","","synthesis as described","3","P n m a","-P 2ac 2n","62","","","","- Cl6 Mo2 S2 -","- Cl6 Mo2 S2 -","- Cl48 Mo16 S16 -","8","1","","Islam, Saiful M.; Subrahmanyam, Kota S.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","One-Dimensional Molybdenum Thiochlorides and Their Use in High Surface Area MoSxChalcogels","Chemistry of Materials","2014","26","17","5151","","10.1021/cm5024579","","x-ray","0.71073","MoKα","","0.0527","0.0252","","","0.0343","0.0379","","","","","","0.826","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002056","16.381","0.003","6.5399","0.0013","12.107","0.002","90","","130.85","0.03","90","","981.1","0.5","293","2","293","2","","","","","","","synthesis as described","3","C 1 2/c 1","-C 2yc","15","","","","- Cl3 Mo Se -","- Cl3 Mo Se -","- Cl24 Mo8 Se8 -","8","1","","Islam, Saiful M.; Subrahmanyam, Kota S.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","One-Dimensional Molybdenum Thiochlorides and Their Use in High Surface Area MoSxChalcogels","Chemistry of Materials","2014","26","17","5151","","10.1021/cm5024579","","x-ray","0.71073","MoKα","","0.0208","0.0159","","","0.0341","0.0351","","","","","","0.991","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002057","8.5422","0.0003","9.9173","0.0004","16.6816","0.0007","88.534","0.003","77.551","0.003","84.358","0.003","1373.27","0.09","295","1","295","1","","","","","","","","6","P 1","P 1","1","","","","- C50 H44 Co2 Cu N14 O22 -","- C50 H38 Co2 Cu N14 O22 -","- C50 H38 Co2 Cu N14 O22 -","1","1","","Stankiewicz, Jolanta; Tomás, Milagros; Dobrinovitch, Isabel T.; Forcén-Vázquez, Elena; Falvello, Larry R.","Proton Conduction in a Nonporous One Dimensional Coordination Polymer","Chemistry of Materials","2014","26","18","5282","","10.1021/cm502142a","","","0.71073","MoKα","","0.0475","0.0395","","","0.0891","0.0949","","","","","","1.038","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002058","8.0655","0.0011","8.0655","0.0011","3.2857","0.0007","90","","90","","90","","213.74","0.06","293","2","293","2","","","","","","","","4","I 4/m","-I 4","87","Calcium nitridomagnesoaluminate","Calcium nitridomagnesoaluminate","","- Al2 Ca Mg2 N4 -","- Al2 Ca Mg2 N4 -","- Al4 Ca2 Mg4 N8 -","2","0.125","","Pust, Philipp; Hintze, Frauke; Hecht, Cora; Weiler, Volker; Locher, Andreas; Zitnanska, Daniela; Harm, Sascha; Wiechert, Detlef; Schmidt, Peter J.; Schnick, Wolfgang","Group (III) NitridesM[Mg2Al2N4] (M= Ca, Sr, Ba, Eu) and Ba[Mg2Ga2N4]—Structural Relation and Nontypical Luminescence Properties of Eu2+Doped Samples","Chemistry of Materials","2014","26","21","6113","","10.1021/cm502280p","","","0.71073","MoKα","","0.0323","0.0311","","","0.0849","0.0864","","","","","","1.199","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002059","8.1008","0.0011","8.1008","0.0011","3.3269","0.0007","90","","90","","90","","218.32","0.06","293","2","293","2","","","","","","","","4","I 4/m","-I 4","87","Strontium nitridomagnesioaluminate","Strontium nitridomagnesioaluminate","","- Al2 Mg2 N4 Sr -","- Al2 Mg2 N4 Sr -","- Al4 Mg4 N8 Sr2 -","2","0.125","","Pust, Philipp; Hintze, Frauke; Hecht, Cora; Weiler, Volker; Locher, Andreas; Zitnanska, Daniela; Harm, Sascha; Wiechert, Detlef; Schmidt, Peter J.; Schnick, Wolfgang","Group (III) NitridesM[Mg2Al2N4] (M= Ca, Sr, Ba, Eu) and Ba[Mg2Ga2N4]—Structural Relation and Nontypical Luminescence Properties of Eu2+Doped Samples","Chemistry of Materials","2014","26","21","6113","","10.1021/cm502280p","","","0.71073","MoKα","","0.0313","0.0309","","","0.0834","0.0838","","","","","","1.165","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002060","8.2602","0.0009","8.2602","0.0009","3.432","0.0002","90","","90","","90","","234.17","0.04","297","2","297","2","","","","","","","","4","I 4/m","-I 4","87","Barium Magnesonitridoaluminate","Barium Magnesonitridoaluminate","","- Al2 Ba Mg2 N4 -","- Al2 Ba Mg2 N4 -","- Al4 Ba2 Mg4 N8 -","2","0.125","","Pust, Philipp; Hintze, Frauke; Hecht, Cora; Weiler, Volker; Locher, Andreas; Zitnanska, Daniela; Harm, Sascha; Wiechert, Detlef; Schmidt, Peter J.; Schnick, Wolfgang","Group (III) NitridesM[Mg2Al2N4] (M= Ca, Sr, Ba, Eu) and Ba[Mg2Ga2N4]—Structural Relation and Nontypical Luminescence Properties of Eu2+Doped Samples","Chemistry of Materials","2014","26","21","6113","","10.1021/cm502280p","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.03365","","1.363","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002061","8.1539","0.0012","8.1539","0.0012","3.343","0.0007","90","","90","","90","","222.26","0.07","293","2","293","2","","","","","","","","4","I 4/m","-I 4","87","","","","- Al2 Eu Mg2 N4 -","- Al2 Eu Mg2 N4 -","- Al4 Eu2 Mg4 N8 -","2","0.125","","Pust, Philipp; Hintze, Frauke; Hecht, Cora; Weiler, Volker; Locher, Andreas; Zitnanska, Daniela; Harm, Sascha; Wiechert, Detlef; Schmidt, Peter J.; Schnick, Wolfgang","Group (III) NitridesM[Mg2Al2N4] (M= Ca, Sr, Ba, Eu) and Ba[Mg2Ga2N4]—Structural Relation and Nontypical Luminescence Properties of Eu2+Doped Samples","Chemistry of Materials","2014","26","21","6113","","10.1021/cm502280p","","","0.71073","MoKα","","0.0152","0.0152","","","0.0333","0.0333","","","","","","1.105","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002062","8.3654","0.0012","8.3654","0.0012","3.4411","0.0007","90","","90","","90","","240.81","0.07","293","2","293","2","","","","","","","","4","I 4/m","-I 4","87","","","","- Ba Ga2 Mg2 N4 -","- Ba Ga2 Mg2 N4 -","- Ba2 Ga4 Mg4 N8 -","2","0.125","","Pust, Philipp; Hintze, Frauke; Hecht, Cora; Weiler, Volker; Locher, Andreas; Zitnanska, Daniela; Harm, Sascha; Wiechert, Detlef; Schmidt, Peter J.; Schnick, Wolfgang","Group (III) NitridesM[Mg2Al2N4] (M= Ca, Sr, Ba, Eu) and Ba[Mg2Ga2N4]—Structural Relation and Nontypical Luminescence Properties of Eu2+Doped Samples","Chemistry of Materials","2014","26","21","6113","","10.1021/cm502280p","","","0.71073","MoKα","","0.0155","0.0146","","","0.0305","0.0309","","","","","","1.101","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002063","12.6509","0.0003","5.6642","0.0002","8.9319","0.0004","90","","98.125","0.004","90","","633.61","0.04","295","","295","","","","","","","","synthesis as described","3","C 1 2 1","C 2y","5","","","","- Cu5 Se7 Sn2 -","- Cu5 Se7 Sn2 -","- Cu10 Se14 Sn4 -","2","0.5","","Fan, Jing; Carrillo-Cabrera, Wilder; Antonyshyn, Iryna; Prots, Yurii; Veremchuk, Igor; Schnelle, Walter; Drathen, Christina; Chen, Lidong; Grin, Yuri","Crystal Structure and Physical Properties of Ternary Phases around the Composition Cu5Sn2Se7with Tetrahedral Coordination of Atoms","Chemistry of Materials","2014","26","18","5244","","10.1021/cm501899q","powder diffraction","","0.430459","synchrotron","","","","","","","","","0.0589","1.04","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002064","5.74738","0.00001","5.74738","0.00001","11.45583","0.00003","90","","90","","90","","378.413","0.0014","873","","873","","","","","","","","high temperature synchrotron diffraction","3","I -4 2 m","I -4 2","121","","","","- Cu5.6 Se8 Sn2.4 -","- Cu5.598 Se8 Sn2.402 -","- Cu5.598 Se8 Sn2.402 -","1","0.0625","","Fan, Jing; Carrillo-Cabrera, Wilder; Antonyshyn, Iryna; Prots, Yurii; Veremchuk, Igor; Schnelle, Walter; Drathen, Christina; Chen, Lidong; Grin, Yuri","Crystal Structure and Physical Properties of Ternary Phases around the Composition Cu5Sn2Se7with Tetrahedral Coordination of Atoms","Chemistry of Materials","2014","26","18","5244","","10.1021/cm501899q","powder diffraction","","0.430459","synchrotron","","","","","","","","","0.0315","1.02","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002065","4.05128","0.00015","4.05128","0.00015","10.3625","0.0006","90","","90","","90","","170.078","0.013","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.72 La -","- As2 Co1.722 La -","- As4 Co3.444 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.5398","neutron","","","","","","","","","9.3461","1.7","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002066","4.0444","0.0003","4.0444","0.0003","10.52","0.0007","90","","90","","90","","172.08","0.02","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.98 La -","- As2 Co1.982 La -","- As4 Co3.964 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","20.7777","2.72","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002067","4.0449","0.0002","4.0449","0.0002","10.4999","0.0007","90","","90","","90","","171.791","0.017","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.92 La -","- As2 Co1.92 La -","- As4 Co3.84 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","19.8294","2.05","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002068","4.047","0.0002","4.047","0.0002","10.4703","0.0006","90","","90","","90","","171.485","0.015","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.82 La -","- As2 Co1.824 La -","- As4 Co3.648 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","16.7285","2.01","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002069","4.052","0.0003","4.052","0.0003","10.3598","0.0008","90","","90","","90","","170.09","0.02","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.7 La -","- As2 Co1.696 La -","- As4 Co3.392 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","22.261","2.13","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002070","4.0546","0.00015","4.0546","0.00015","10.3037","0.0004","90","","90","","90","","169.391","0.011","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.64 La -","- As2 Co1.638 La -","- As4 Co3.276 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","14.4779","1.95","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002071","4.0561","0.00014","4.0561","0.00014","10.2644","0.0004","90","","90","","90","","168.869","0.011","298","2","298","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- As2 Co1.61 La -","- As2 Co1.612 La -","- As4 Co3.224 La2 -","2","0.0625","","Shen, Shijie; Wang, Gang; Jin, Shifeng; Huang, Qingzhen; Ying, Tianping; Li, Dandan; Lai, Xiaofang; Zhou, Tingting; Zhang, Han; Lin, Zhiping; Wu, Xiaozhi; Chen, Xiaolong","Tunable Cobalt Vacancies and Related Properties in LaCoxAs2","Chemistry of Materials","2014","26","21","6221","","10.1021/cm5029639","powder diffraction","","1.78897","CoKα","","","","","","","","","14.7385","1.94","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002073","7.1809","0.0001","7.1809","0.0001","7.1809","0.0001","90","","90","","90","","370.285","0.009","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002074","7.1879","0.0002","7.1879","0.0002","7.1879","0.0002","90","","90","","90","","371.369","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002075","7.1972","0.0002","7.1972","0.0002","7.1972","0.0002","90","","90","","90","","372.813","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002076","7.2089","0.0002","7.2089","0.0002","7.2089","0.0002","90","","90","","90","","374.634","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002077","7.2201","0.0002","7.2201","0.0002","7.2201","0.0002","90","","90","","90","","376.383","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002078","7.2345","0.0002","7.2345","0.0002","7.2345","0.0002","90","","90","","90","","378.639","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002079","7.25","0.0002","7.25","0.0002","7.25","0.0002","90","","90","","90","","381.078","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002080","7.2644","0.0002","7.2644","0.0002","7.2644","0.0002","90","","90","","90","","383.353","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002081","7.2782","0.0002","7.2782","0.0002","7.2782","0.0002","90","","90","","90","","385.542","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002082","7.2919","0.0002","7.2919","0.0002","7.2919","0.0002","90","","90","","90","","387.723","0.018","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","LAMOX","","","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.15 La1.85 Mo2 O8.924 -","- Ba0.3 La3.7 Mo4 O17.848 -","2","0.166667","","Corbel, Gwenaël; Selmi, Ania; Suard, Emmanuelle; Lacorre, Philippe","“Free” Volume Expansion and Formation Enthalpy of Defects as Key Parameters Tuning the Oxide Ionic Conductivity in Derivatives of β-La2Mo2O9","Chemistry of Materials","2014","26","23","6838","","10.1021/cm503461x","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002083","5.3038","0.0001","14.7518","0.0002","10.9877","0.0002","90","","90","","90","","859.68","0.03","100","2","100","2","","","","","","","","3","P c m b","-P 2bc 2c","57","","","","- Ca2 Co2 O5 -","- Ca2 Co2 O5 -","- Ca16 Co16 O40 -","8","1","","Zhang, Junjie; Zheng, Hong; Malliakas, Christos D.; Allred, Jared M.; Ren, Yang; Li, Qing’an; Han, Tian-Heng; Mitchell, J.F.","Brownmillerite Ca2Co2O5: Synthesis, Stability, and Re-entrant Single Crystal to Single Crystal Structural Transitions","Chemistry of Materials","2014","26","24","7172","","10.1021/cm503873x","","","0.71073","MoKα","","0.0382","0.0235","","","0.0605","0.0682","","","","","","1.039","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002084","5.2896","0.0001","14.924","0.0002","10.9547","0.0002","90","","90","","90","","864.79","0.03","300","2","300","2","","","","","","","","3","P c m b","-P 2bc 2c","57","","","","- Ca2 Co2 O5 -","- Ca2 Co2 O5 -","- Ca16 Co16 O40 -","8","1","","Zhang, Junjie; Zheng, Hong; Malliakas, Christos D.; Allred, Jared M.; Ren, Yang; Li, Qing’an; Han, Tian-Heng; Mitchell, J.F.","Brownmillerite Ca2Co2O5: Synthesis, Stability, and Re-entrant Single Crystal to Single Crystal Structural Transitions","Chemistry of Materials","2014","26","24","7172","","10.1021/cm503873x","","","0.71073","MoKα","","0.0374","0.0221","","","0.062","0.0703","","","","","","1","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002085","5.3028","0.0001","14.7838","0.0003","10.981","0.0002","90","","90.173","0.001","90","","860.86","0.03","200","2","200","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- Ca2 Co2 O5 -","- Ca2 Co2 O5 -","- Ca16 Co16 O40 -","8","2","","Zhang, Junjie; Zheng, Hong; Malliakas, Christos D.; Allred, Jared M.; Ren, Yang; Li, Qing’an; Han, Tian-Heng; Mitchell, J.F.","Brownmillerite Ca2Co2O5: Synthesis, Stability, and Re-entrant Single Crystal to Single Crystal Structural Transitions","Chemistry of Materials","2014","26","24","7172","","10.1021/cm503873x","","","0.71073","MoKα","","0.0528","0.0265","","","0.0655","0.076","","","","","","0.984","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002086","5.2944","0.0001","14.8022","0.0003","10.9667","0.0002","90.078","0.001","90","","90","","859.45","0.03","240","2","240","2","","","","","","","","3","P 2/c 1 1","-P 2xc","13","","","","- Ca2 Co2 O5 -","- Ca2 Co2 O5 -","- Ca16 Co16 O40 -","8","2","","Zhang, Junjie; Zheng, Hong; Malliakas, Christos D.; Allred, Jared M.; Ren, Yang; Li, Qing’an; Han, Tian-Heng; Mitchell, J.F.","Brownmillerite Ca2Co2O5: Synthesis, Stability, and Re-entrant Single Crystal to Single Crystal Structural Transitions","Chemistry of Materials","2014","26","24","7172","","10.1021/cm503873x","","","0.71073","MoKα","","0.0521","0.0299","","","0.0779","0.0871","","","","","","1.05","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002087","7.54873","0.00004","11.43897","0.00005","11.468","0.00006","90","","109.318","0.0003","90","","934.506","0.008","300","","300","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","a-Gd2 Mo3 O12","","","- Gd2 Mo3 O12 -","- Gd2 Mo3 O12 -","- Gd8 Mo12 O48 -","4","0.5","","Morozov, Vladimir A.; Raskina, Maria V.; Lazoryak, Bogdan I.; Meert, Katrien W.; Korthout, Katleen; Smet, Philippe F.; Poelman, Dirk; Gauquelin, Nicolas; Verbeeck, Johan; Abakumov, Artem M.; Hadermann, Joke","Crystal Structure and Luminescent Properties of R2‒xEux(MoO4)3(R = Gd, Sm) Red Phosphors","Chemistry of Materials","2014","26","24","7124","","10.1021/cm503720s","powder diffraction","x-ray","0.39996","SynchrotronX-ray","","0.0267","0.0267","","0.0348","0.0347","","","","2.34","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002088","10.41525","0.00001","10.44871","0.00001","10.73114","0.00001","90","","90","","90","","1167.83","0.0019","300","","300","","","","","","","","","3","P b a 2","P 2 -2ab","32","b'-Eu2 Mo3 O12","","","- Eu2 Mo3 O12 -","- Eu2 Mo3 O12 -","- Eu8 Mo12 O48 -","4","1","","Morozov, Vladimir A.; Raskina, Maria V.; Lazoryak, Bogdan I.; Meert, Katrien W.; Korthout, Katleen; Smet, Philippe F.; Poelman, Dirk; Gauquelin, Nicolas; Verbeeck, Johan; Abakumov, Artem M.; Hadermann, Joke","Crystal Structure and Luminescent Properties of R2‒xEux(MoO4)3(R = Gd, Sm) Red Phosphors","Chemistry of Materials","2014","26","24","7124","","10.1021/cm503720s","powder diffraction","x-ray","0.39996","SynchrotronX-ray","","0.0343","0.032","","0.0357","0.035","","","","1.55","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4002170","6.2359","0.0002","6.2359","0.0002","32.2139","0.0005","90","","90","","120","","1084.86","0.05","298","","298","","","","","","","","","3","P -6 2 c","P -6c -2c","190","","","","- Cu3.2 O30 Ta11 -","- Cu3.192 O30 Ta11 -","- Cu6.384 O60 Ta22 -","2","0.166667","","Sullivan, Ian; Sahoo, Prangya P.; Fuoco, Lindsay; Hewitt, Andrew S.; Stuart, Sean; Dougherty, Daniel; Maggard, Paul A.","Cu-Deficiency in thep-Type Semiconductor Cu5‒xTa11O30: Impact on Its Crystalline Structure, Surfaces, and Photoelectrochemical Properties","Chemistry of Materials","2014","26","23","6711","","10.1021/cm502891t","powder diffraction","","1.54187","CuKα","","0.0396","0.0391","","","0.0256","0.0256","","","","","","1.88","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002452","4.79674","0.00049","5.47004","0.0005","14.2965","0.0021","89.867","0.014","89.885","0.016","90","0.012","375.11","0.08","300","","300","","","","","","","","","5","P 1","P 1","1","","","","- Ba3 N8 O8 Si8 Sr -","- Ba3 N8 O8 Si8 Sr -","- Ba3 N8 O8 Si8 Sr -","1","1","","Guogang Li; Chun Che Lin; Wei-Ting Chen; Maxim S. Molokeev; Victor V. Atuchin; Chang-Yang Chiang; Wuzong Zhou; Chin-Wei Wang; Wen-Hsien Li; Hwo-Shuenn Sheu; Ting-Shan Chan; ChongGeng Ma; Ru-Shi Liu","Photoluminescence Tuning via Cation Substitution in Oxonitridosilicate Phosphors: DFT Calculations, Different Site Occupations, and Luminescence Mechanisms","Chemistry of Materials","2014","26","9","2991","","10.1021/cm500844v","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","","","","1.304","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""