# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-07T10:31:30+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Chemistry of Materials (1,1989-') AND volume = 6 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
"1000369","3.8289","0.0001","3.8289","0.0001","41.75699","0.001","90","","90","","90","","612.2","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Mercury dithallium(III) tribarium strontium dicopper oxide","","- Ba3 Cu2 Hg O10 Sr Tl2 -","- Ba3 Cu2 Hg O10 Sr Tl2 -","- Ba6 Cu4 Hg2 O20 Sr2 Tl4 -","2","0.0625","","Goutenoire, F; Hervieu, M; Martin, C; Maignan, A; Michel, C; Letouze, F; Raveau, B","Cationic substitutions in the ""2201-1201"" intergrowth Hg Tl2 Ba4 Cu2 O10","Chemistry of Materials (1,1989-","1994","6","","1654","1658","10.1021/cm00046a017","","","","","","0.075","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1006074","3.9367","0.0003","3.9367","0.0003","15.805","0.002","90","","90","","90","","244.9","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Dilanthanum dibarium dicopper dititanium oxide","","- Ba2 Cu2 La2 O11 Ti2 -","- Ba2 Cu2 La2 O11 Ti2 -","- Ba2 Cu2 La2 O11 Ti2 -","1","0.0625","","Gomez-Romero, P; Palacin, M R; Rodriguez-Carvajal, J","Crystal structure refinement of the layered copper-titanium perovskites Ln2 Ba2 Cu2 Ti2 O11 (Ln=La, Nd) from neutron powder diffraction data","Chemistry of Materials (1,1989-","1994","6","","2118","2122","10.1021/cm00047a036","","","","","","0.068","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1006075","3.91275","0.00006","3.91275","0.00006","15.7614","0.0003","90","","90","","90","","241.3","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Dineodymium dibarium dicopper dititanium oxide","","- Ba2 Cu2 Nd2 O11 Ti2 -","- Ba2 Cu2 Nd2 O11 Ti2 -","- Ba2 Cu2 Nd2 O11 Ti2 -","1","0.0625","","Gomez-Romero, P; Palacin, M R; Rodriguez-Carvajal, J","Crystal structure refinement of the layered copper-titanium perovskites Ln2 Ba2 Cu2 Ti2 O11 (Ln=La, Nd) from neutron powder diffraction data","Chemistry of Materials (1,1989-","1994","6","","2118","2122","10.1021/cm00047a036","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"6000662","8.8212","","9.2173","","5.4772","","102.622","","97.748","","102.459","","416.53","","","","","","","","","","","","","3","P -1","","","","","","- O10 P2 U2 -","","","","","","Benard, P.; Louer, D.; Dacheux, N.; Brandel, V.; Genet, M.","U(UO2)((PO4)2, a new mixed-valence uranium orthophosphate - ab-initio structure determination from powder diffraction data and optical and X-RAY photoelectro spectra","Chemistry of Materials","1994","6","","1049","1058","10.1021/cm00043a029","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000663","19.549","","19.549","","19.549","","90","","90","","90","","7470.91","","","","","","","","","","","","","5","P43-n","","","","","","- C16 H48 Ge4 N4 S10 -","","","","","","Pivan, J. Y.; Achak, O.; Louer, M.; Louer, D.","The novel thiogermanate [(CH3)4N]4GE4S10 with a high cubic cell-volume - ab-initio structure determination from conventional X-ray-powder diffraction","Chemistry of Materials","1994","6","","827","830","10.1021/cm00042a021","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""