# Search results of SQL query from the Crystallography Open Database # Date and time performed: 2025-01-04T23:28:32+01:00 # Query: # SELECT data.* # FROM # data # WHERE # (status is null or status != 'retracted') and # (volume = 150 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 "1008448","3.8415","0.0003","3.8707","0.0003","27.24","0.002","90","","90","","90","","405","","","","","","","","","","","","","4","A m m m","-A 2 2","65","","Yttrium barium copper oxide (1/2/4/8.1)","","- Ba2 Cu4 O8.06 Y -","- Ba2 Cu4 O8.056 Y -","- Ba4 Cu8 O16.112 Y2 -","2","0.125","","Karpinski, J; Kaldis, E; Rusiecki, S; Jilek, E; Fischer, P; Bordet, P; Chaillout, C; Chenavas, J; Hodeau, J L; Marezio, M","Two New Bulk Superconducting Phases in the Y-Ba-Cu-O System: Y Ba~2~ Cu~3.5~ O~7+x~ (T~c~ 40K) and Y Ba~2~ Cu~4~ O~8+x~ (T~c~ 80K)","Journal of the Less-Common Metals","1989","150","","129","137","10.1016/0022-5088(89)90262-2","","","","","","0.068","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00","" "1010550","11.83","0.005","11.83","0.005","11.83","0.005","90","","90","","90","","1655.6","","","","","","","","","","","","","5","","","","","Tricaesium dodecatungstatophosphate hydrate","","- Cs3 H2 O41 P W12 -","","","","","","Santos, J A","An X-Ray Study of the Caesium Salts of Certain 12-Heteropoly Acids","Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-)","1935","150","","309","322","10.1098/rspa.1935.0103","","","","","","","","","","","","","","","","","","","","","","278158","2022-09-26","15:28:11","" "1010551","11.832","0.004","11.832","0.004","11.832","0.004","90","","90","","90","","1656.4","","","","","","","","","","","","","5","","","","","Tricaesium dihydrogen dodecatungstoborate hydrate","","- B Cs3 H4 O41 W12 -","","","","","","Santos, J A","An X-Ray Study of the Caesium Salts of Certain 12-Heteropoly Acids","Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-)","1935","150","","309","322","10.1098/rspa.1935.0103","","","","","","","","","","","","","","","","","","","","","","278158","2022-09-26","15:28:11","" "1010552","11.79","0.01","11.79","0.01","11.79","0.01","90","","90","","90","","1638.9","","","","","","","","","","","","","4","","","","","Caesium tungstate hydrate *","","- Cs3 H7 O41 W12 -","","","","","","Santos, J A","An X-Ray Study of the Caesium Salts of Certain 12-Heteropoly Acids","Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-)","1935","150","","309","322","10.1098/rspa.1935.0103","","","","","","","","","","","","","","","","","","","","","","278158","2022-09-26","15:28:11","" "1510589","3.837","","3.875","","50.492","","90","","90","","90","","750.734","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","Ba4 Er2 Cu6.84 Au0.16 O15","","- Au0.16 Ba4 Cu6.84 Er2 O15 -","- Au0.16 Ba4 Cu6.84 Er2 O15 -","- Au0.32 Ba8 Cu13.68 Er4 O30 -","2","0.125","","Waszczak, J.V.; Siegrist, T.; Schneemeyer, L.F.; van Dover, R.B.","Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al","Journal of Solid State Chemistry","2000","150","","228","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00","" "1514045","25.4788","","25.5137","","8.2687","","90","","90","","90","","5375.14","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Lithium Manganese Oxide (1/2/4)","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li72 Mn144 O288 -","72","2.25","","Nakayama, M.; Nogami, M.","A first-principles study on phase transition induced by charge ordering of Mn3+/Mn4+ in spinel Li Mn2 O4","Solid State Communications","2010","150","","1329","1333","10.1016/j.ssc.2010.05.006","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00","" "1520810","7.9231","","9.3099","","6.2582","","107.395","","100.98","","105.675","","405.227","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu2 Fe4 (Cu0.4 Fe0.6) (P O4)6","","- Cu2.4 Fe4.6 O24 P6 -","- Cu2.4 Fe4.6 O24 P6 -","- Cu2.4 Fe4.6 O24 P6 -","1","0.5","","Belik, A.A.; Malakho, A.P.; Lazoryak, B.I.; Pokholov, K.V.; Khasanov, S.S.","New mixed-valent iron(II/III) phosphates, Cu3-x Fe4+x (P O4)6","Journal of Solid State Chemistry","2000","150","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","140356","2020-10-21","18:00:00","" "1520812","7.9434","","9.3089","","6.2654","","107.564","","101.04","","105.643","","406.112","","","","","","","","","","","","","4","P -1","-P 1","2","","Cu2 Fe5 (P O4)6","","- Cu2 Fe5 O24 P6 -","- Cu2 Fe5 O24 P6 -","- Cu2 Fe5 O24 P6 -","1","0.5","","Belik, A.A.; Malakho, A.P.; Khasanov, S.S.; Lazoryak, B.I.; Pokholov, K.V.","New mixed-valent iron(II/III) phosphates, Cu3-x Fe4+x (P O4)6","Journal of Solid State Chemistry","2000","150","","159","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","140358","2020-10-21","18:00:00","" "1520823","6.09556","","5.4886","","5.183","","90","","90","","90","","173.403","","","","","","","","","","","","","2","P b c m","-P 2c 2b","57","","Tl F","","- F Tl -","- F Tl -","- F4 Tl4 -","4","0.5","","Berastegui, P.; Hull, S.","The crystal structures of thallium(I) fluoride","Journal of Solid State Chemistry","2000","150","","266","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520825","3.78283","","3.78283","","6.12312","","90","","90","","90","","87.621","","","","","","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","","Tl F","","- F Tl -","- F Tl -","- F2 Tl2 -","2","0.125","","Berastegui, P.; Hull, S.","The crystal structures of thallium(I) fluoride","Journal of Solid State Chemistry","2000","150","","266","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520868","5.94761","","6.09707","","8.48555","","90","","90.042","","90","","307.711","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Sr1.25 Bi0.75 O3","","- Bi0.75 O3 Sr1.25 -","- Bi0.75 O3 Sr1.25 -","- Bi3 O12 Sr5 -","4","1","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Pshirkov, J.S.; Putilin, S.N.; Antipov, E.V.; Dooryhee, E.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00","" "1520874","5.92803","","5.92803","","8.4301","","90","","90","","90","","296.247","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O3","","- Bi K0.6 O3 Sr0.4 -","- Bi K0.6 O3 Sr0.4 -","- Bi4 K2.4 O12 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Antipov, E.V.; Pshirkov, J.S.; Dooryhee, E.; Putilin, S.N.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520877","5.95493","","5.95493","","8.4508","","90","","90","","90","","299.675","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.84","","- Bi K0.6 O2.84 Sr0.4 -","- Bi K0.6 O2.84 Sr0.4 -","- Bi4 K2.4 O11.36 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Fitch, A.; Antipov, E.V.; Pshirkov, J.S.; Putilin, S.N.; Dooryhee, E.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520878","5.96045","","5.96045","","8.4545","","90","","90","","90","","300.363","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.66","","- Bi K0.6 O2.66 Sr0.4 -","- Bi K0.6 O2.66 Sr0.4 -","- Bi4 K2.4 O10.64 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Kazakov, S.M.; Pshirkov, J.S.; Antipov, E.V.; Putilin, S.N.; Dooryhee, E.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520879","5.9655","","5.9655","","8.4581","","90","","90","","90","","301","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.62","","- Bi K0.6 O2.62 Sr0.4 -","- Bi K0.6 O2.62 Sr0.4 -","- Bi4 K2.4 O10.48 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Bordet, P.; Antipov, E.V.; Pshirkov, J.S.; Kazakov, S.M.; Dooryhee, E.; Putilin, S.N.; Fitch, A.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520880","5.97122","","5.97122","","8.4648","","90","","90","","90","","301.816","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Sr0.4 K0.6) Bi O2.53","","- Bi K0.6 O2.53 Sr0.4 -","- Bi K0.6 O2.53 Sr0.4 -","- Bi4 K2.4 O10.12 Sr1.6 -","4","0.125","","Bougerol-Chaillout, C.; Antipov, E.V.; Kazakov, S.M.; Bordet, P.; Pshirkov, J.S.; Fitch, A.; Putilin, S.N.; Dooryhee, E.","Structure determination of Sr1.25 Bi0.75 O3 and Sr0.4 K0.6 Bi O3 as a function of temperature from synchrotron X-ray powder diffraction data","Journal of Solid State Chemistry","2000","150","","316","323","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520893","5.4762","","7.7438","","5.4892","","90","","90","","90","","232.778","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Pr0.5 Sr0.5) Fe O3","","- Fe O3 Pr0.5 Sr0.5 -","- Fe O3 Pr0.5 Sr0.5 -","- Fe4 O12 Pr2 Sr2 -","4","0.5","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520894","3.89264","","3.89264","","3.89264","","90","","90","","90","","58.984","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Pr0.333 Sr0.667) Fe O2.68","","- Fe O2.68 Pr0.333 Sr0.667 -","- Fe O2.679 Pr0.333 Sr0.667 -","- Fe O2.679 Pr0.333 Sr0.667 -","1","0.0208333","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520896","5.4765","","5.4765","","13.3892","","90","","90","","120","","347.769","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Pr Sr2) Fe3 O8.83","","- Fe3 O8.83 Pr Sr2 -","- Fe3 O8.829 Pr0.999 Sr2.001 -","- Fe6 O17.658 Pr1.998 Sr4.002 -","2","0.0555556","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520898","10.9012","","10.9012","","7.6792","","90","","90","","90","","912.567","","","","","","","","","","","","","4","P 4/n n c :2","-P 4a 2bc","126","","(Pr0.1 Sr0.9) Fe O2.80","","- Fe O2.8 Pr0.1 Sr0.9 -","- Fe O2.7999 Pr0.1 Sr0.9 -","- Fe16 O44.7984 Pr1.6 Sr14.4 -","16","1","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520912","5.5192","","7.7557","","5.4858","","90","","90","","90","","234.821","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Pr0.8 Sr0.2) Fe O3","","- Fe O3 Pr0.8 Sr0.2 -","- Fe O3 Pr0.8 Sr0.2 -","- Fe4 O12 Pr3.2 Sr0.8 -","4","0.5","","Brinks, H.W.; Fjellvag, H.; Hauback, B.C.; Kjekshus, A.","Structure and magnetism of Pr1-x Srx Fe O3-d","Journal of Solid State Chemistry","2000","150","","233","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521050","7.5916","","6.4713","","7.4216","","90","","90","","90","","364.605","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Li (V O) (As O4)","","- As Li O5 V -","- As Li O5 V -","- As4 Li4 O20 V4 -","4","0.5","","Gaubicher, J.; Villesuzanne, A.; Orsini, F.; Angenault, J.; Llorente, S.; le Mercier, T.; Quarton, M.","Synthesis, structure and physical studies of the new beta-(Li V O As O4) compound","Journal of Solid State Chemistry","2000","150","","250","257","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521067","12.763","","7.31","","30.19","","90","","94.09","","90","","2809.48","","","","","","","","","","","","","5","C 1 2 1","C 2y","5","","(Ca1.747 Sm0.253) (Ta1.84 Ti0.16) O7","","- Ca1.747 O7 Sm0.253 Ta1.84 Ti0.16 -","- Ca1.7468 O7 Sm0.2532 Ta1.8396 Ti0.1602 -","- Ca34.936 O140 Sm5.064 Ta36.792 Ti3.204 -","20","5","","Grey, I.E.; Roth, R.S.","New calcium tantalate polytypes in the system Ca2 Ta2 O7 Sm2 Ti2 O7","Journal of Solid State Chemistry","2000","150","","167","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","140701","2020-10-21","18:00:00","" "1521068","7.353","","7.353","","30.264","","90","","90","","120","","1417.05","","","","","","","","","","","","","5","P 31","P 31","144","","(Ca1.89 Sm0.11) (Ta1.86 Sm0.05 Ti0.10) O7","","- Ca1.89 O7 Sm0.16 Ta1.86 Ti0.1 -","- Ca1.89 O7 Sm0.155 Ta1.86025 Ti0.09475 -","- Ca22.68 O84 Sm1.86 Ta22.323 Ti1.137 -","12","4","","Grey, I.E.; Roth, R.S.","New calcium tantalate polytypes in the system Ca2 Ta2 O7 Sm2 Ti2 O7","Journal of Solid State Chemistry","2000","150","","167","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","140702","2020-10-21","18:00:00","" "1521080","5.5073","","5.5073","","9.9374","","90","","90","","90","","301.405","","","","","","","","","","","","","2","I -4","I -4","82","","","","- Ge Se2 -","- Ge Se2 -","- Ge4 Se8 -","4","0.5","","Grzechnik, A.; Mezouar, M.; Stolen, S.; Bakken, E.; Grande, T.","Structural transformations in three-dimensional crystalline Ge Se2 at high pressures and high temperatures","Journal of Solid State Chemistry","2000","150","","121","127","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1521095","9.946","","3.744","","20.994","","90","","93.3","","90","","780.475","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","Ti6 O11","","- O11 Ti6 -","- O11 Ti6 -","- O44 Ti24 -","4","0.5","","Grey, I.E.; Cranswick, L.M.D.; Li, C.; White, T.J.; Bursill, L.A.","New M3 O5 - anatase intergrowth structures formed during low-temperature oxidation of anosovite","Journal of Solid State Chemistry","2000","150","","128","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","140737","2020-10-21","18:00:00","" "1521176","5.623","","5.623","","7.964","","90","","90","","90","","251.807","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Ba La Mg Ru O6","","- Ba La Mg O6 Ru -","- Ba La Mg O6 Ru -","- Ba2 La2 Mg2 O12 Ru2 -","2","0.125","","Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Lee, J.-S.; Lee, C.-H.; Shim, H.-S.","Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)","Journal of Solid State Chemistry","2000","150","","383","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521177","5.6521","","5.6521","","7.9987","","90","","90","","90","","255.528","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Ba La Zn Ru O6","","- Ba La O6 Ru Zn -","- Ba La O6 Ru Zn -","- Ba2 La2 O12 Ru2 Zn2 -","2","0.125","","Hong, K.-P.; Choi, Y.-H.; Jung, D.-Y.; Kwon, Y.-U.; Shim, H.-S.; Lee, J.-S.; Lee, C.-H.","Atomic and magnetic long-range orderings in Ba La M Ru O6 (M = Mg and Zn)","Journal of Solid State Chemistry","2000","150","","383","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521302","3.8313","","3.8373","","11.5275","","90","","90","","90","","169.476","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","Er Ba Sr Cu2.9 (P O4)0.1 O6.61","","- Ba Cu2.9 Er O7.01 P0.1 Sr -","- Ba Cu2.9 Er O7.01 P0.1 Sr -","- Ba Cu2.9 Er O7.01 P0.1 Sr -","1","0.125","","Marimuthu, K.N.; Malik, S.K.; Varadaraju, U.V.; Raveau, B.; Yelon, W.B.; Hervieu, M.","Electron microscopy and neutron diffraction studies on Er Ba Sr Cu3-x (P O4)x Oy (x = 0.0, 0.10, 0.20)","Journal of Solid State Chemistry","2000","150","","188","195","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521304","3.3318","","3.3318","","57.95","","90","","90","","120","","557.111","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Zn0.9 Mg0.1 O)5 In2 O3","","- In2 Mg0.5 O8 Zn4.5 -","- In2 Mg0.5 O8 Zn4.5 -","- In6 Mg1.5 O24 Zn13.5 -","3","0.0833333","","Masuda, Y.; Pitschke, W.; Ohta, M.; Seo, W.-S.; Koumoto, K.","Structure and thermoelectric transport properties of isoelectronically substituted (Zn O)5 In2 O3","Journal of Solid State Chemistry","2000","150","","221","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","141044","2020-10-21","18:00:00","" "1521305","3.3284","","3.3284","","58.066","","90","","90","","120","","557.088","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Zn0.95 Co0.05 O)5 In2 O3","","- Co0.25 In2 O8 Zn4.75 -","- Co0.27 In1.99 O8 Zn4.75 -","- Co0.81 In5.97 O24 Zn14.25 -","3","0.0833333","","Masuda, Y.; Ohta, M.; Seo, W.-S.; Koumoto, K.; Pitschke, W.","Structure and thermoelectric transport properties of isoelectronically substituted (Zn O)5 In2 O3","Journal of Solid State Chemistry","2000","150","","221","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","141045","2020-10-21","18:00:00","" "1521420","3.8069","","3.8069","","30.055","","90","","90","","90","","435.572","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (La2 Sr2) Ni2 O9","","- La2 Ni2 O9 Sr2 Tl -","- La2 Ni2 O9 Sr2 Tl -","- La4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2) Ni2 O9, Ln= La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521421","3.7864","","3.7864","","29.804","","90","","90","","90","","427.295","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Pr2 Sr2) Ni2 O9","","- Ni2 O9 Pr2 Sr2 Tl -","- Ni2 O9 Pr2 Sr2 Tl -","- Ni4 O18 Pr4 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521422","3.7794","","3.7794","","29.697","","90","","90","","90","","424.188","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Nd2 Sr2) Ni2 O9","","- Nd2 Ni2 O9 Sr2 Tl -","- Nd2 Ni2 O9 Sr2 Tl -","- Nd4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521423","3.7718","","3.7718","","29.524","","90","","90","","90","","420.022","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Sm2 Sr2) Ni2 O9","","- Ni2 O9 Sm2 Sr2 Tl -","- Ni2 O9 Sm2 Sr2 Tl -","- Ni4 O18 Sm4 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2) Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521424","3.7711","","3.7711","","29.421","","90","","90","","90","","418.402","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Eu2 Sr2) Ni2 O9","","- Eu2 Ni2 O9 Sr2 Tl -","- Eu2 Ni2 O9 Sr2 Tl -","- Eu4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521425","3.7667","","3.7667","","29.39","","90","","90","","90","","416.986","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Tl (Gd2 Sr2) Ni2 O9","","- Gd2 Ni2 O9 Sr2 Tl -","- Gd2 Ni2 O9 Sr2 Tl -","- Gd4 Ni4 O18 Sr4 Tl2 -","2","0.0625","","Knee, C.S.; Weller, M.T.","Synthesis and structure of a new family of nickelates: Tl (Ln2 Sr2)Ni2 O9, Ln = La, Pr, Nd, Sm, Eu and Gd","Journal of Solid State Chemistry","2000","150","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521500","5.56133","","5.76733","","9.74629","","90","","124.81","","90","","256.662","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ca2 (Ca0.667 Nb0.333) Nb O6","","- Ca2.667 Nb1.333 O6 -","- Ca2.667 Nb1.333 O6 -","- Ca5.334 Nb2.666 O12 -","2","0.5","","Levin, I.; Bendersky, L.A.; Cline, J.P.; Roth, R.S.; Vanderah, T.A.","Octahedral tilting and cation ordering in perovskite-like Ca4 Nb2 O9 = 3 . Ca (Ca1/3 Nb2/3) O3 polymorphs","Journal of Solid State Chemistry","2000","150","","43","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","141712","2020-10-21","18:00:00","" "1521536","4.893","","4.893","","47.78","","90","","90","","120","","990.666","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Sr Al2 (B2 O7)","","- Al2 B2 O7 Sr -","- Al2 B2 O7 Sr -","- Al12 B12 O42 Sr6 -","6","0.166667","","Lucas, F.; Jaulmes, S.; Quarton, M.; le Mercier, T.; Fouassier, C.; Guillen, F.","Crystal structure of Sr Al2 B2 O7 and Eu(2+) luminescence","Journal of Solid State Chemistry","2000","150","","404","409","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521671","3.4185","","3.4185","","25.463","","90","","90","","120","","257.698","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Lu Fe Zn O4","","- Fe Lu O4 Zn -","- Fe Lu O4 Zn -","- Fe3 Lu3 O12 Zn3 -","3","0.0833333","","Nespolo, M.; Nakamura, M.; Ohashi, H.","Reinvestigation of the Lu Fe O3 (Zn O)m homologous series: insightsfrom charge distribution analysis on the effect of the coordinationpolyhedra shape on the cation distribution","Journal of Solid State Chemistry","2000","150","","96","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521683","15.144","","3.596","","14.972","","90","","90.08","","90","","815.342","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Ba1.128 V8 O21","","- Ba1.128 O21 V8 -","- Ba1.128 O21 V8 -","- Ba2.256 O42 V16 -","2","0.25","","Oka, Y.; Yao, T.; Yamamoto, N.","Hydrothermal synthesis and crystal structure of a new barium vanadium bronze Ba1+x V8 O21 with a tunnel structure","Journal of Solid State Chemistry","2000","150","","330","335","","","","","","","","","","","","","","","","","","","","","","has coordinates","141896","2020-10-21","18:00:00","" "1521739","5.3219","","5.4283","","7.5564","","90","","90","","90","","218.296","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.97 Co0.03) O3","","- Co0.03 Ni0.97 O3 Sm -","- Co0.03 Ni0.97 O3 Sm -","- Co0.12 Ni3.88 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521740","5.3182","","5.4195","","7.5462","","90","","90","","90","","217.496","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.7 Co0.3) O3","","- Co0.3 Ni0.7 O3 Sm -","- Co0.3 Ni0.7 O3 Sm -","- Co1.2 Ni2.8 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Sanchez, R.; Garcia, J.; Blasco, J.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521741","5.3099","","5.4078","","7.5335","","90","","90","","90","","216.324","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.5 Co0.5) O3","","- Co0.5 Ni0.5 O3 Sm -","- Co0.5 Ni0.5 O3 Sm -","- Co2 Ni2 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521742","5.3021","","5.3952","","7.5226","","90","","90","","90","","215.191","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.3 Co0.7) O3","","- Co0.7 Ni0.3 O3 Sm -","- Co0.7 Ni0.3 O3 Sm -","- Co2.8 Ni1.2 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Sanchez, R.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521743","5.2925","","5.3704","","7.509","","90","","90","","90","","213.427","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","Sm (Ni0.1 Co0.9) O3","","- Co0.9 Ni0.1 O3 Sm -","- Co0.9 Ni0.1 O3 Sm -","- Co3.6 Ni0.4 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Blasco, J.; Garcia, J.; Sanchez, R.","Relationships between structure and physical properties in Sm Ni1-x Cox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521744","5.2831","","5.3502","","7.4962","","90","","90","","90","","211.885","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sm (Co O3)","","- Co O3 Sm -","- Co O3 Sm -","- Co4 O12 Sm4 -","4","0.5","","Perez-Cacho, J.; Sanchez, R.; Blasco, J.; Garcia, J.","Relationships between structure and physical properties in Sm Ni1-xCox O3","Journal of Solid State Chemistry","2000","150","","145","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521860","5.881","","8.127","","6.259","","90","","96.35","","90","","297.313","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","K2 (Mn F5) (H2 O)","","- F5 H2 K2 Mn O -","- F5 H2 K2 Mn O -","- F10 H4 K4 Mn2 O2 -","2","0.5","","Roisnel, T.; Nunez, P.; Tressaud, A.; Molins, E.; Rodriguez-Carvajal, J.","Investigation of K2 Mn F5 . (H2 O) by neutron diffraction","Journal of Solid State Chemistry","2000","150","","104","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521927","3.8526","","3.8746","","50.41049","","90","","90","","90","","752.492","","","","","","","","","","","","","5","A m m m","-A 2 2","65","","Ba4 Er2 Cu6.58 Al0.42 O14.88","","- Al0.42 Ba4 Cu6.58 Er2 O14.88 -","- Al0.416 Ba4 Cu6.584 Er2 O14.88 -","- Al0.832 Ba8 Cu13.168 Er4 O29.76 -","2","0.125","","Siegrist, T.; Waszczak, J.V.; van Dover, R.B.; Schneemeyer, L.F.","Structural effects of impurities in Ba4 Er2 Cu7 O15-d: incorporation of Au and of Al","Journal of Solid State Chemistry","2000","150","","228","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00","" "1522005","8.3903","","8.3903","","8.3903","","90","","90","","90","","590.653","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Ba2 Yb Ta O6","","- Ba2 O6 Ta Yb -","- Ba2 O6 Ta Yb -","- Ba8 O24 Ta4 Yb4 -","4","0.0208333","","Taira, N.; Hinatsu, Y.","Magnetic susceptibility of Ba2 Yb Ta O6 with the ordered perovskite structure and electron paramagnetic resonance of Yb(3+) doped in Ba2 Lu Ta O6","Journal of Solid State Chemistry","2000","150","","31","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1522258","9.067","","9.067","","9.067","","90","","90","","90","","745.403","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Cs2 K Mn F6","","- Cs2 F6 K Mn -","- Cs2 F6 K Mn -","- Cs8 F24 K4 Mn4 -","4","0.0208333","","Xu, Y.; Carlson, S.; Norrestam, R.; Sjoedin, A.","Phase transition in Cs2 K Mn F6: crystal structures of lowand high-temperature modifications","Journal of Solid State Chemistry","2000","150","","399","403","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1522264","5.2916","","5.2916","","4.9987","","90","","90","","120","","121.216","","","","","","","","","","","","","3","P -3 1 m","-P 3 2","162","","Nb2 (N0.86 O0.14)","","- N0.86 Nb2 O0.14 -","- N0.86 Nb2 O0.14 -","- N2.58 Nb6 O0.42 -","3","0.25","","Yamada, K.; Sato, N.; Masuda, H.; Fujino, T.","Synthesis and crystal structure of a new niobium oxynitride, Nb2 N0.88 O0.12","Journal of Solid State Chemistry","2000","150","","36","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","142485","2020-10-21","18:00:00","" "1531048","8.51","","8.51","","21.087","","90","","90","","120","","1322.53","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Mn0.5 Ti2 (P O4)3","","- Mn0.5 O12 P3 Ti2 -","- Mn0.5 O12 P3 Ti2 -","- Mn3 O72 P18 Ti12 -","6","0.333333","","Aatiq, A.; Menetrier, M.; El Jazouli, A.; Delmas, C.","Structural and lithium intercalation studies of Mn0.5-x Cax Ti2 (P O4)3 phases (0 <= x <= 0.5)","Solid State Ionics","2002","150","","391","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","156361","2020-10-21","18:00:00","" "1531049","8.425","","8.425","","21.576","","90","","90","","120","","1326.3","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","Mn0.25 Ca0.25 Ti2 (P O4)3","","- Ca0.25 Mn0.25 O12 P3 Ti2 -","- Ca0.25 Mn0.25 O12 P3 Ti2 -","- Ca1.5 Mn1.5 O72 P18 Ti12 -","6","0.333333","","Aatiq, A.; Menetrier, M.; El Jazouli, A.; Delmas, C.","Structural and lithium intercalation studies of Mn0.5-x Cax Ti2 (P O4)3 phases (0 <= x <= 0.5)","Solid State Ionics","2002","150","","391","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","156362","2020-10-21","18:00:00","" "1531050","8.547","","8.547","","20.959","","90","","90","","120","","1325.95","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","Li0.5 Mn0.5 Ti2 (P O4)3","","- Li0.5 Mn0.5 O12 P3 Ti2 -","- Li0.5 Mn0.5 O12 P3 Ti2 -","- Li3 Mn3 O72 P18 Ti12 -","6","0.166667","","Aatiq, A.; Delmas, C.; Menetrier, M.; El Jazouli, A.","Structural and lithium intercalation studies of Mn0.5-x Cax Ti2 (P O4)3 phases (0 <= x <= 0.5)","Solid State Ionics","2002","150","","391","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","156363","2020-10-21","18:00:00","" "1531590","12.0772","","12.0772","","12.0772","","90","","90","","90","","1761.56","","","","","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","H3 P W12 O40 (H2 O)6","","- H15 O46 P W12 -","- H15 O46 P W12 -","- H30 O92 P2 W24 -","2","0.0416667","","Kremenovic, A.; Bouree, F.; Spasojevic-de Bire, A.; Colomban, P.; Mioc, U.B.; Davidovic, M.; Dimitrijevic, R.","Structural modifications of dodecatungstophosphoric acid hexahydrate induced by temperature in the 10 - 358 K range. In situ high-resolution neutron powder diffraction investigation","Solid State Ionics","2002","150","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1532253","2.96533","","2.96533","","11.1695","","90","","90","","120","","85.057","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Na0.667 Co0.333 Ti0.667 O2","","- Co0.333 Na0.667 O2 Ti0.667 -","- Co0.333 Na0.67 O2 Ti0.667 -","- Co0.666 Na1.34 O4 Ti1.334 -","2","0.0833333","","Shin, Y.-J.; Kwak, J.H.; Park, M.-H.; Namgoong, H.; Han, O.H.","Ionic conduction properties of layer-type oxides Nax M(II)x/2 Ti(IV)1-x/2 O2 (M = Ni, Co; 0.60 <= x <= 1.0)","Solid State Ionics","2002","150","","363","372","","","","","","","","","","","","","","","","","","","","","","has coordinates","157935","2020-10-21","18:00:00","" "1533234","5.1164","","5.1164","","8.3727","","90","","90","","120","","189.813","","","","","","","","","","","","","4","P 63 2 2","P 6c 2c","182","","(Sr0.88 Eu0.12) (Al2 O4)","","- Al2 Eu0.12 O4 Sr0.88 -","- Al2 Eu0.12 O4.068 Sr0.88 -","- Al4 Eu0.24 O8.136 Sr1.76 -","2","0.166667","","Yamada, H.; Shi, W.S.; Nishikubo, K.; Xu, C.N.","Determination of the crystal structure of spherical particles of Sr Al2 O4:Eu prepared by the spray method","Journal of the Electrochemical Society","2003","150","","E251","E254","","","","","","","","","","","","","","","","","","","","","","has coordinates","159357","2020-10-21","18:00:00","" "1533971","2.96749","","2.96749","","14.4969","","90","","90","","120","","110.557","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li (Li0.2 Ir0.4 Fe0.4) O2","","- Fe0.4 Ir0.4 Li1.2 O2 -","- Fe0.4 Ir0.4 Li1.2 O2 -","- Fe1.2 Ir1.2 Li3.6 O6 -","3","0.0833333","","Kobayashi, H.; Uebou, Y.; Tabuchi, M.; Tamaki, J.; Kageyama, H.; Matsuoka, M.; Yamamoto, Y.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160264","2020-10-21","18:00:00","" "1533973","2.9621","","2.9621","","14.4901","","90","","90","","120","","110.104","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li (Li0.2 Ir0.333 Fe0.467) O2","","- Fe0.467 Ir0.333 Li1.2 O2 -","- Fe0.467 Ir0.333 Li1.2 O2 -","- Fe1.401 Ir0.999 Li3.6 O6 -","3","0.0833333","","Kobayashi, H.; Uebou, Y.; Yamamoto, Y.; Tabuchi, M.; Kageyama, H.; Matsuoka, M.; Tamaki, J.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160266","2020-10-21","18:00:00","" "1533976","2.9545","","2.9545","","14.4861","","90","","90","","120","","109.509","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.9675 Ir0.0325) (Li0.1925 Fe0.587 Ir0.2205) O2","","- Fe0.587 Ir0.253 Li1.16 O2 -","- Fe0.587 Ir0.253 Li1.16 O2 -","- Fe1.761 Ir0.759 Li3.48 O6 -","3","0.0833333","","Kobayashi, H.; Matsuoka, M.; Uebou, Y.; Kageyama, H.; Tabuchi, M.; Yamamoto, Y.; Tamaki, J.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160269","2020-10-21","18:00:00","" "1533977","2.9714","","2.9714","","14.5009","","90","","90","","120","","110.879","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li0.8 (Li0.2 Fe0.4 Ir0.4) O2","","- Fe0.4 Ir0.4 Li O2 -","- Fe0.4 Ir0.4 Li O2 -","- Fe1.2 Ir1.2 Li3 O6 -","3","0.0833333","","Kobayashi, H.; Tabuchi, M.; Uebou, Y.; Kageyama, H.; Yamamoto, Y.; Matsuoka, M.; Tamaki, J.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533979","2.9759","","2.9759","","14.3868","","90","","90","","120","","110.34","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li0.2 (Li0.2 Ir0.362 Fe0.4) Ir0.038 O2","","- Fe0.4 Ir0.4 Li0.4 O2 -","- Fe0.4 Ir0.4 Li0.4 O2 -","- Fe1.2 Ir1.2 Li1.2 O6 -","3","0.0833333","","Kobayashi, H.; Tabuchi, M.; Uebou, Y.; Matsuoka, M.; Kageyama, H.; Yamamoto, Y.; Tamaki, J.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160273","2020-10-21","18:00:00","" "1533981","2.9707","","2.9707","","14.3524","","90","","90","","120","","109.691","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Li0.09 (Li0.2 Ir0.357 Fe0.4) Ir0.043 O2","","- Fe0.4 Ir0.4 Li0.29 O2 -","- Fe0.4 Ir0.4 Li0.29 O2 -","- Fe1.2 Ir1.2 Li0.87 O6 -","3","0.0833333","","Kobayashi, H.; Uebou, Y.; Tabuchi, M.; Kageyama, H.; Yamamoto, Y.; Matsuoka, M.; Tamaki, J.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160276","2020-10-21","18:00:00","" "1533982","2.9784","","2.9784","","14.525","","90","","90","","120","","111.587","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Li0.5486 Ir0.0244) (Li0.2244 Fe0.4 Ir0.3756) O2","","- Fe0.4 Ir0.4 Li0.773 O2 -","- Fe0.4 Ir0.4 Li0.773 O2 -","- Fe1.2 Ir1.2 Li2.319 O6 -","3","0.0833333","","Kobayashi, H.; Yamamoto, Y.; Uebou, Y.; Tamaki, J.; Kageyama, H.; Tabuchi, M.; Matsuoka, M.","Structure, physical properties and charge-discharge characteristics of Fe-doped Li2 Ir O3","Journal of the Electrochemical Society","2003","150","","A1408","A1415","","","","","","","","","","","","","","","","","","","","","","has coordinates","160279","2020-10-21","18:00:00","" "1541445","11.77","","11.77","","11.77","","90","","90","","90","","1630.53","","","","","","","","","","","","","6","I a -3 d","-I 4bd 2c 3","230","","(Ca2.472 Fe0.528) (Al1.94 Fe0.06) Si2.829 O11.316 (O H)0.684","","- Al1.94 Ca2.472 Fe0.588 H0.684 O12 Si2.829 -","- Al1.94 Ca2.472 Fe0.588 O12 Si2.829 -","- Al15.52 Ca19.776 Fe4.704 O96 Si22.632 -","8","0.0833333","","Basso, R.; Messiga, B.; Cimmino, F.","Crystal chemical and petrological study of hydrogarnets from a Fe-gabbro metarodingite","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1984","150","","247","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1541620","18.9","","7.47","","5.68","","90","","90","","101.33","","786.292","","","","","","","","","","","","","6","P 1","P 1","1","","Na Ca2 Ti (Si2 O7) O F","","- Ca2 F Na O8 Si2 Ti -","- Ca2 F Na O8 Si2 Ti -","- Ca8 F4 Na4 O32 Si8 Ti4 -","4","4","","Kheirov, M.B.; Mamedov, Kh.S.; Belov, N.V.","Crystal structure of rinkite Na (Ca, Ce)2 (Ti, Ce) O (Si2 O7) F","Doklady Akademii Nauk SSSR","1963","150","","162","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1542066","7.4","","14.4","","7.05","","90","","90","","90","","751.248","","","","","","","","","","","","","5","P b m m","-P 2 2b","51","","Na2 Zr Si6 O15 (H2 O)3","","- H6 Na2 O18 Si6 Zr -","- Na2 O18 Si6 Zr -","- Na4 O36 Si12 Zr2 -","2","0.25","","Neronova, N.N.; Belov, N.V.","Crystal structure of elpidite Na2 Zr Si6 O15 (H2 O)3. dimorphism of the dimetasilicate radical Si6 O15","Doklady Akademii Nauk SSSR","1963","150","","642","645","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1542068","9.652","","8.868","","5.194","","90","","108.48","","90","","421.65","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Mg0.985 Fe0.015) (Si O3)","","- Fe0.015 Mg0.985 O3 Si -","- Fe0.015 Mg0.985 O3 Si -","- Fe0.12 Mg7.88 O24 Si8 -","8","2","","Pannhorst, W.","High temperature crystal structure refinements of low-clinoenstatite up to 700 degrees C","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1984","150","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1542117","10.64","","18.36","","5.04","","90","","90","","90","","984.566","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Zn3 (P O4)2 (H2 O)4","","- H8 O12 P2 Zn3 -","- O12 P2 Zn3 -","- O48 P8 Zn12 -","4","0.5","","Gamidov, R.S.; Mamedov, Kh.S.; Golovachev, V.P.; Belov, N.V.","Crystal structure of hopeite Zn3 (P O4)2 (H2 O)4","Doklady Akademii Nauk SSSR","1963","150","","381","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","174120","2020-10-21","18:00:00","" "1542157","9.675","","8.889","","5.207","","90","","108.6","","90","","424.418","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Mg (Si O3)","","- Mg O3 Si -","- Mg O3 Si -","- Mg8 O24 Si8 -","8","2","","Pannhorst, W.","High temperature crystal structure refinements of low-clinoenstatite up to 700 degrees C","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1984","150","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1548776","9.4366","0.0001","10.2859","0.0001","17.2936","0.0002","90","","93.2219","0.0004","90","","1675.93","0.03","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H13 N5 O2 Zn -","- C17 H13 N5 O2 Zn -","- C68 H52 N20 O8 Zn4 -","4","1","","Shaowei Zhang; Yong Zhang; Shigang Ning; Ruiren Tang; Zilong Tang; Yuan Xie","A 3D supramolecular network as highly selective and sensitive luminescent sensor for PO43- and Cu2+ ions in aqueous media","Dyes and Pigments","2018","150","","36","43","10.1016/j.dyepig.2017.11.008","","","0.71073","MoKα","","0.0296","0.0247","","","0.0569","0.0598","","","","","","1.035","","","","has coordinates,has disorder","205630","2020-10-21","18:00:00","" "6000148","15.144","","3.596","","14.972","","90","","90.08","","90","","815.34","","","","","","","","","","","","","3","C 1 2/m 1","","","","","","- Ba1.13 O21 V8 -","","","","","","Oka, Y.; Yao, T.; Yamamoto, N.","Hydrothermal synthesis and crystal structure of a new barium vanadium bronze Ba1+xV8O21 with a tunnel structure","Journal of Solid State Chemistry","2000","150","","330","335","10.1006/jssc.1999.8598","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000149","7.723","","10.155","","12.505","","90","","90","","90","","980.73","","","","","","","","","","","","","4","P 21 21 21","","","","","","- B6 Na3 O13 V -","","","","","","Touboul, M.; Penin, N.; Nowogrocki, G.","Synthesis and crystal structure of the first fully characterized vanadoborate Na-3[B6O9(VO4)]","Journal of Solid State Chemistry","2000","150","","342","346","10.1006/jssc.1999.8600","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000154","17.978","","13.561","","7.163","","90","","90","","90","","1746.34","","","","","","","","","","","","","4","C m c m","","","","","","- H10 O19 U3 V2 -","","","","","","Saadi, M.; Dion, C.; Abraham, F.","Synthesis and crystal structure of the pentahydrated uranyl orthovanadate (UO2)(3)(VO4)(2) 5H(2)O, precursor for the new (UO2)(3)(VO4)(2) uranyl-vanadate","Journal of Solid State Chemistry","2000","150","","72","80","10.1006/jssc.1999.8549","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000233","9.936","","3.744","","20.994","","90","","93.3","","90","","779.69","","","","","","","","","","","","","2","C 1 2/m 1","","","","","","- Mn6 O11 -","","","","","","Cranswick, L. M. D.; Li, C.; White, T. J.; Bursill, L. A.","New M3O5-anatase intergrowth structures formed during low-temperature oxidation of anosovite","Journal of Solid State Chemistry","2000","150","","128","138","10.1006/jssc.1999.8564","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000718","22.033","","7.6003","","6.6418","","90","","103.813","","90","","1080.05","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C4 H6 K La O11 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000719","22.13","","7.774","","6.655","","90","","105.28","","90","","1104.44","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- C4 H10 La N O11 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00","" "6000720","5.687","0.003","15.241","0.005","9.017","0.004","90","","92.82","0.03","90","","780.6","0.4","","","","","","","","","","","","4","","","","","","","- C4 K La O8 -","","","","","","Bataille, T.; Louer, M.; Auffredic, J. P.; Louer, D.","Crystal structure and thermal behavior of La(H2O)(2)M(C2O4)(2).H2O (M = K, NH4) studied by powder X-ray diffraction","Journal of Solid State Chemistry","2000","150","","81","95","10.1006/jssc.1999.8550","","","","","","","","","","","","","","","","","","","","","","203578","2020-10-21","18:00:00","" "8103534","6.837","","17.845","","6.633","","90","","90","","90","","809.268","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- Rb2 S5 -","- Rb2 S5 -","- Rb8 S20 -","4","1","","Boettcher, P.","Synthesis and crystal structure of the rubidium pentachalcogenides Rb2 S5 and Rb2 Se5","Zeitschrift fuer Kristallographie (149,1979-)","1979","150","","65","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8103535","7.135","","18.299","","6.91","","90","","90","","90","","902.193","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- Rb2 Se5 -","- Rb2 Se5 -","- Rb8 Se20 -","4","1","","Boettcher, P.","Synthesis and crystal structure of the rubidium pentachalcogenides Rb2 S5 and Rb2 Se5","Zeitschrift fuer Kristallographie (149,1979-)","1979","150","","65","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8103594","13.343","","60.022","","4.033","","90","","90","","90","","3229.92","","","","","","","","","","","","","3","B b m m","-B 2 2b","63","","Bi20.90 Pb4.65 S36","","- Bi20.9 Pb4.65 S36 -","- Bi20.9 Pb4.65 S36 -","- Bi41.8 Pb9.3 S72 -","2","0.125","","Takeuchi, Y.; Ozawa, T.; Takagi, J.","Tropochemical cell-twinning and the 60-A-structure of phase V in the Pb S - Bi2 S3 system","Zeitschrift fuer Kristallographie (149,1979-)","1979","150","","75","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00","" "8104300","13.465","","15.745","","30.058","","90","","116.51","","90","","5702.46","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Cu31 S16 -","- Cu31 S16 -","- Cu248 S128 -","8","2","","Evans, H.T.","The crystal structures of low chalcocite and djurleite","Zeitschrift fuer Kristallographie (149,1979-)","1979","150","","299","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8104328","4.033","","13.343","","60.022","","90","","90","","90","","3229.92","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Bi41.88 Pb9.32 S76 -","- Bi41.88 Pb9.32 S76 -","- Bi41.88 Pb9.32 S76 -","1","0.0625","","Takeuchi, Y.; Takagi, J.; Ozawa, T.","Tropochemical cell-twinning and the 60-A-structure of phase V in the Pb S - Bi2 S3 system","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979)","1979","150","","75","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8104337","16.32","","42.636","","8.543","","83.98","","89.06","","83.2","","5869.97","","","","","","","","","","","","","5","P 1","P 1","1","","Pb4 Sb21 Tl8 As19 S68","","- As19 Pb4 S68 Sb21 Tl8 -","- As19 Pb4 S68 Sb21 Tl8 -","- As19 Pb4 S68 Sb21 Tl8 -","1","1","","Nagl, A.","The crystal structure of a thallium sulfosalt Tl8 Pb4 Sb21 As19 S68","Zeitschrift fuer Kristallographie (149,1979-)","1979","150","","85","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","172577","2020-10-21","18:00:00","" "9008282","4.952","","4.952","","23.275","","90","","90","","90","","570.757","","","","","","","","","","","","rodingitic dykes in a ophiolitic zone in the Taurus Mountains,","5","I 41/a :2","-I 4ad","88","","","Chantalite","- Al2 Ca H4 O8 Si -","- Al2 Ca H4 O8 Si -","- Al8 Ca4 H16 O32 Si4 -","4","0.25","","Liebich, B. W.; Sarp, H.; Parthe, E.","The crystal structure of chantalite, CaAl2(OH)4SiO4 southwest Turkey","Zeitschrift fur Kristallographie","1979","150","","53","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008283","8.3593","","4.9725","","6.1975","","90","","114.83","","90","","233.795","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","Zabuyelite","- C Li2 O3 -","- C Li2 O3 -","- C4 Li8 O12 -","4","0.5","","Effenberger, H.; Zemann, J.","Verfeinerung der kristallstruktur des lithiumkarbonates, Li2CO3","Zeitschrift fur Kristallographie","1979","150","","133","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008284","5.5387","","5.5387","","5.5387","","90","","90","","90","","169.912","","","","","","","","","","","","Shinkolobwe Mine, Katanga, Zaire","4","P a -3","-P 2ac 2ab 3","205","","","Cattierite","- Co0.8 Fe0.11 Ni0.09 S2 -","- Co0.8 Fe0.11 Ni0.09 S2 -","- Co3.2 Fe0.44 Ni0.36 S8 -","4","0.166667","","Pratt, J. L.; Bayliss, P.","Crystal-structure refinement of cattierite Note: pyrite structure","Zeitschrift fur Kristallographie","1979","150","","163","167","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008285","11.878","","11.878","","11.878","","90","","90","","90","","1675.83","","","","105","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- D18 Na3 O9 S4 Sb -","- D18 Na3 O9 S4 Sb -","- D72 Na12 O36 S16 Sb4 -","4","0.333333","","Mereiter, K.; Preisinger, A.; Guth, H.; Heger, G.; Hiebl, K.; Mikenda, W.","Hydrogen bonds in Schlippe's salt, Na3SbS4*9H2O and Na3SbS4*9D2O: Diffraction and spectroscopic studies in the temperature range of 75K to 295 K Note: sample at T = 105 K","Zeitschrift fur Kristallographie","1979","150","","215","229","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008286","14.263","","7.62","","10.025","","90","","93.27","","90","","1087.78","","","","","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","","- Ca3 Mn2 O14 Si4 -","- Ca3 Mn2 O14 Si4 -","- Ca12 Mn8 O56 Si16 -","4","0.5","","Moore, P. B.; Araki, T.","Crystal structure of synthetic Ca3Mn2O2[Si4O12] Note: stable only at P greater than 1.3 GPa","Zeitschrift fur Kristallographie","1979","150","","287","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008287","15.246","","11.884","","13.494","","90","","116.35","","90","","2190.86","","","","","","","","","","","","Bristol Connecticut, USA","2","P 1 21/c 1","-P 2ybc","14","","","Chalcocite","- Cu2 S -","- Cu2 S -","- Cu96 S48 -","48","12","","Evans, H. T.","The crystal structures of low chalocite and djurleite","Zeitschrift fur Kristallographie","1979","150","","299","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9008288","26.897","","15.745","","13.565","","90","","90.13","","90","","5744.67","","","","","","","","","","","","Ozark Lead Co. mine at Sweetwater, Missouri, USA","2","P 1 21/n 1","-P 2yn","14","","","Djurleite","- Cu31 S16 -","- Cu31 S16 -","- Cu248 S128 -","8","2","","Evans, H. T.","The crystal structures of low chalocite and djurleite","Zeitschrift fur Kristallographie","1979","150","","299","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9009215","6.27","","6.27","","5.79","","90","","90","","90","","227.622","","","","","","","","","","","","","2","P 42/n m c :1","P 4n 2n -1n","137","","","Ice","- H2 O -","- H2 O -","- H24 O12 -","12","0.75","","Kamb, B.","Structure of ice VI","Science","1965","150","","205","209","10.1126/science.150.3693.205","","","","","","","","","","","","","","","","","","","","","has coordinates","283962","2023-05-23","09:03:55","" "9011429","16.32","","21.318","","8.543","","83.98","","89.06","","83.2","","2934.99","","","","","","","","","","","","Jas Roux, France","5","P 1","P 1","1","","","Chabourneite","- As19 Pb4 S68 Sb21 Tl8 -","- As19 Pb4 S68 Sb21 Tl8 -","- As19 Pb4 S68 Sb21 Tl8 -","1","1","","Nagl, A.","The crystal structure of a thallium sulfosalt, Tl8Pb4Sb21As19S68","Zeitschrift fur Kristallographie","1979","150","","85","106","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""