# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-24T07:08:40+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 'Nanoscale') AND volume = 8 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
"1540703","47.6239","0.0019","16.6379","0.0007","36.1489","0.0013","90","","127.438","0.002","90","","22742.9","1.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C180 H150 Ag12 Au13 Cl8 P10 -","- C180 H150 Ag12 Au13 Cl8 P10 -","- C720 H600 Ag48 Au52 Cl32 P40 -","4","0.5","","Liu, Lingli; Song, Yongbo; Chong, Hanbao; Yang, Sha; Xiang, Ji; Jin, Shan; Kang, Xi; Zhang, Jun; Yu, Haizhu; Zhu, Manzhou","Size-confined growth of atom-precise nanoclusters in metal-organic frameworks and their catalytic applications.","Nanoscale","2016","8","3","1407","1412","10.1039/c5nr06930k","","","0.71073","MoKα","","0.0896","0.054","","","0.1475","0.1592","","","","","","0.981","","","","has coordinates","176123","2020-10-21","18:00:00",""
"1541907","5.385","0.008","9.274","0.013","25.69","0.04","92.65","0.02","95.509","0.019","93.348","0.02","1273","3","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- C55 H82 N2 O8 S -","- C55 H82 N2 O8 S -","- C55 H82 N2 O8 S -","1","1","","Nuthanakanti, Ashok; Srivatsan, Seergazhi G.","Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.","Nanoscale","2016","8","6","3607","3619","10.1039/c5nr07490h","","","0.71073","MoKα","","0.2437","0.1082","","","0.2511","0.3229","","","","","","1.001","","","","has coordinates,has disorder","177883","2020-10-21","18:00:00",""
"1541908","5.4174","0.0005","9.3296","0.0009","24.033","0.002","95.858","0.002","92.994","0.002","93.33","0.002","1204.23","0.19","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- C51 H74 N2 O8 S -","- C51 H74 N2 O8 S -","- C51 H74 N2 O8 S -","1","1","","Nuthanakanti, Ashok; Srivatsan, Seergazhi G.","Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.","Nanoscale","2016","8","6","3607","3619","10.1039/c5nr07490h","","","0.71073","MoKα","","0.0918","0.0676","","","0.1557","0.17","","","","","","1.054","","","","has coordinates","301779","2025-08-18","16:06:43",""
"1541909","8.671","0.007","11.183","0.009","27.36","0.02","94.389","0.014","97.977","0.016","109.553","0.014","2454","3","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C50.5 H79.5 N2.5 O9.5 -","- C50.5 H79.5 N2.5 O9.5 -","- C101 H159 N5 O19 -","2","2","","Nuthanakanti, Ashok; Srivatsan, Seergazhi G.","Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.","Nanoscale","2016","8","6","3607","3619","10.1039/c5nr07490h","","","0.71073","MoKα","","0.2949","0.0725","","","0.1467","0.2409","","","","","","0.643","","","","has coordinates","301779","2025-08-18","16:06:43",""
"1541910","8.615","0.003","11.124","0.004","25.315","0.009","101.343","0.007","91.424","0.007","109.601","0.006","2229.9","1.4","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C46.5 H71.5 N2.5 O9.5 -","- C46.5 H71.5 N2.5 O9.5 -","- C93 H143 N5 O19 -","2","2","","Nuthanakanti, Ashok; Srivatsan, Seergazhi G.","Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.","Nanoscale","2016","8","6","3607","3619","10.1039/c5nr07490h","","","0.71073","MoKα","","0.1361","0.0652","","","0.1124","0.1372","","","","","","0.958","","","","has coordinates","301779","2025-08-18","16:06:43",""
"1543077","11.1685","0.0011","12.4485","0.0012","18.1823","0.0018","77.032","0.004","82.429","0.004","89.334","0.004","2441.5","0.4","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C98 H112 Cl4 Ni6 S12 -","- C98 H112 Cl4 Ni6 S12 -","- C98 H112 Cl4 Ni6 S12 -","1","0.5","","Joya, Khurram S.; Sinatra, Lutfan; AbdulHalim, Lina G.; Joshi, Chakra P.; Hedhili, M. N.; Bakr, Osman M.; Hussain, Irshad","Atomically monodisperse nickel nanoclusters as highly active electrocatalysts for water oxidation.","Nanoscale","2016","8","18","9695","9703","10.1039/c6nr00709k","","","1.54178","CuKα","","0.0564","0.052","","","0.145","0.1519","","","","","","1.063","","","","has coordinates,has disorder","183717","2020-10-21","18:00:00",""
"1543078","12.957","0.0009","15.3918","0.001","16.9527","0.0011","86.571","0.002","70.541","0.002","73.4","0.002","3052.6","0.4","140","1","140","1","","","","","","","","4","P -1","-P 1","2","","","","- C64 H72 Ni4 S8 -","- C64 H72 Ni4 S8 -","- C128 H144 Ni8 S16 -","2","1","","Joya, Khurram S.; Sinatra, Lutfan; AbdulHalim, Lina G.; Joshi, Chakra P.; Hedhili, M. N.; Bakr, Osman M.; Hussain, Irshad","Atomically monodisperse nickel nanoclusters as highly active electrocatalysts for water oxidation.","Nanoscale","2016","8","18","9695","9703","10.1039/c6nr00709k","","","1.54178","CuKα","","0.026","0.0244","","","0.0626","0.0639","","","","","","1.025","","","","has coordinates","301779","2025-08-18","16:06:46",""
"1543197","7.5752","0.0018","25.656","0.005","11.692","0.002","90","","100.74","0.013","90","","2232.5","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H12 N3 O3 -","- C21 H12 N3 O3 -","- C84 H48 N12 O12 -","4","1","","Bhattacharjee, Subham; Maiti, Bappa; Bhattacharya, Santanu","First report of charge-transfer induced heat-set hydrogel. Structural insights and remarkable properties.","Nanoscale","2016","8","21","11224","11233","10.1039/c6nr01128d","","","0.71073","MoKα","","0.2061","0.1417","","","0.4057","0.4303","","","","","","1.359","","","","has coordinates","183718","2020-10-21","18:00:00",""
"1543198","8.1387","0.0007","10.1108","0.0009","16.5691","0.0015","96.538","0.005","97.798","0.005","107.518","0.005","1270.8","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H14 N6 O6 -","- C26 H14 N6 O6 -","- C52 H28 N12 O12 -","2","1","","Bhattacharjee, Subham; Maiti, Bappa; Bhattacharya, Santanu","First report of charge-transfer induced heat-set hydrogel. Structural insights and remarkable properties.","Nanoscale","2016","8","21","11224","11233","10.1039/c6nr01128d","","","0.71073","MoKα","","0.0684","0.0547","","","0.1595","0.1675","","","","","","1.076","","","","has coordinates","301779","2025-08-18","16:06:46",""
"1543199","13.7021","0.0005","19.5675","0.0009","31.9547","0.0013","103.934","0.003","95.761","0.002","105.409","0.002","7891.9","0.6","223","2","223","1","","","","","","","","6","P -1","-P 1","2","","","","- C218 H328 N12 Nd8 Ni6 O94 -","- C218 H328 N12 Nd8 Ni6 O94 -","- C218 H328 N12 Nd8 Ni6 O94 -","1","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.1188","0.0762","","","0.1682","0.1914","","","","","","1.113","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1543200","54.07","0.011","60.708","0.012","90.132","0.018","90","","90","","90","","295857","10","223","1","223","1","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C376 H490 Cd24 Cl4 N24 O136 Yb8 -","- C376 H490 Cd24 Cl4 N24 O136 Yb8 -","- C6016 H7840 Cd384 Cl64 N384 O2176 Yb128 -","16","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.2013","0.0955","","","0.2258","0.242","","","","","","1.065","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1543201","54.405","0.011","61.195","0.012","91.022","0.018","90","","90","","90","","303041","10","223","2","223","1","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C376 H490 Cd24 Cl4 N24 Nd8 O136 -","- C376 H490 Cd24 Cl4 N24 Nd8 O136 -","- C6016 H7840 Cd384 Cl64 N384 Nd128 O2176 -","16","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.1798","0.1034","","","0.2692","0.3134","","","","","","0.935","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1543202","13.643","0.003","19.294","0.004","31.918","0.006","103.53","0.03","95.86","0.03","106.04","0.03","7725","3","223","2","223","1","","","","","","","","6","P -1","-P 1","2","","","","- C224 H342 N12 Ni6 O98 Yb8 -","- C224 H342 N12 Ni6 O98 Yb8 -","- C224 H342 N12 Ni6 O98 Yb8 -","1","0.5","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.1439","0.0876","","","0.2092","0.2499","","","","","","1.036","","","","has coordinates","183719","2020-10-21","18:00:00",""
"1543203","56.782","0.011","62.983","0.013","44.704","0.009","90","","90","","90","","159875","6","223","1","223","1","","","","","","","","6","C 2 2 2","C 2 2","21","","","","- C384 H504 Cd24 N24 O144 Sm8 -","- C384 H504 Cd24 N24 O144 Sm8 -","- C3072 H4032 Cd192 N192 O1152 Sm64 -","8","1","","Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.","Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.","Nanoscale","2016","8","21","11123","11129","10.1039/c6nr00642f","","","0.710747","MoKα","","0.2276","0.1089","","","0.2519","0.3063","","","","","","0.863","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1543626","8.082","0.004","11.9","0.006","18.387","0.009","96.689","0.007","97.921","0.008","102.152","0.008","1692.8","1.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H7 N O3 S -","- C8 H7 N O3 S -","- C64 H56 N8 O24 S8 -","8","4","","Shi, Lei; Yang, Jian Hai; Zeng, Hai Bo; Chen, Yong Mei; Yang, Sheng Chun; Wu, Chao; Zeng, Hao; Yoshihito, Osada; Zhang, Qiqing","Carbon dots with high fluorescence quantum yield: the fluorescence originates from organic fluorophores.","Nanoscale","2016","8","30","14374","14378","10.1039/c6nr00451b","","","0.71073","MoKα","","0.0813","0.0444","","","0.0962","0.1128","","","","","","1.016","","","","has coordinates","301779","2025-08-18","16:06:47",""
"1543627","11.021","0.005","9.374","0.004","18.596","0.008","90","","90","","90","","1921.2","1.5","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9 H7 N O5 S -","- C9 H7 N O5 S -","- C72 H56 N8 O40 S8 -","8","1","","Shi, Lei; Yang, Jian Hai; Zeng, Hai Bo; Chen, Yong Mei; Yang, Sheng Chun; Wu, Chao; Zeng, Hao; Yoshihito, Osada; Zhang, Qiqing","Carbon dots with high fluorescence quantum yield: the fluorescence originates from organic fluorophores.","Nanoscale","2016","8","30","14374","14378","10.1039/c6nr00451b","","","0.71073","MoKα","","0.0309","0.0285","","","0.0728","0.0748","","","","","","1.064","","","","has coordinates","301779","2025-08-18","16:06:47",""
"1543881","58.539","0.004","34.472","0.002","41.488","0.003","90","","91.2322","0.0009","90","","83702","10","293","2","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C240 H312 Ag4 Au32 S24 -","- C240 H310 Ag4 Au32 S24 -","- C2880 H3720 Ag48 Au384 S288 -","12","1.5","","Fan, Jiqiang; Song, Yongbo; Chai, Jinsong; Yang, Sha; Chen, Tao; Rao, Bo; Yu, Haizhu; Zhu, Manzhou","The solely motif-doped Au36-xAgx(SPh-tBu)24 (x = 1-8) nanoclusters: X-ray crystal structure and optical properties.","Nanoscale","2016","8","33","15317","15322","10.1039/c6nr04255d","","","0.71073","MoKα","","0.1859","0.0828","","","0.2137","0.2441","","","","","","1.093","","","","has coordinates,has disorder","187157","2020-10-21","18:00:00",""
"1544250","35.113","0.004","34.407","0.004","24.991","0.003","90","","100.595","0.002","90","","29678","6","120","2","120.15","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C226 H218 Ag38 Au3 Br1.9 Cl25.1 P2 S24 -","- C226 H218 Ag38 Au3 Br1.9 Cl25.1 P2 S24 -","- C904 H872 Ag152 Au12 Br7.6 Cl100.4 P8 S96 -","4","1","","Wang, Zhi; Senanayake, Ravithree; Aikens, Christine M.; Chen, Wen-Miao; Tung, Chen-Ho; Sun, Di","Gold-doped silver nanocluster [Au3Ag38(SCH2Ph)24X5](2-) (X = Cl or Br).","Nanoscale","2016","8","45","18905","18911","10.1039/c6nr06615a","","","0.71073","MoKα","","0.1507","0.0999","","","0.2695","0.2929","","","","","","1.059","","","","has coordinates","190227","2020-10-21","18:00:00",""