# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-30T05:23:32+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 'Journal of Solid State Chemistry') AND volume = 36 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
"1007244","12.033","0.008","12.033","0.008","10.032","0.008","90","","90","","120","","1258","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Triammonium tetrachromatophosphate","","- Cr4 H12 N3 O16 P -","- Cr4 H12 N3 O16 P -","- Cr12 H36 N9 O48 P3 -","3","0.166667","","Averbuch-Pouchot, M T; Durif, A; Guitel, J C","Crystal structure of an ammonium phospho-chromate: (N H4)3 P Cr4 O16","Journal of Solid State Chemistry","1981","36","","381","384","10.1016/0022-4596(81)90450-3","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","301771","2025-08-18","12:22:45",""
"1008122","9.225","0.002","5.632","0.001","19.379","0.0004","90","","103.14","","90","","980.5","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium sulfate bis(antimony fluoride)","","- F6 K2 O4 S Sb2 -","- F6 K2 O4 S Sb2 -","- F24 K8 O16 S4 Sb8 -","4","1","","Bourgault, M; Ducourant, B; Bonnet, B; Fourcade, R","Structure cristalline de K~2~ S O~4~ (Sb F~3~)~2~","Journal of Solid State Chemistry","1981","36","","183","189","10.1016/0022-4596(81)90155-9","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008123","19.98","0.01","8.152","0.003","15.089","0.007","90","","122.32","0.03","90","","2076.9","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(urea) antimony tetrafluoride oxide","","- C2 H8 F4 N4 O3 Sb2 -","- C2 H8 F4 N4 O3 Sb2 -","- C16 H64 F32 N32 O24 Sb16 -","8","1","","Bourgault, M; Fourcade, R; Mascherpa, G","Mise en evidence de l'entite Sb~2~ F~4~ O dans un compose d'addition moleculaire avec l'uree etude structurale de ((N H~2~)~2~ C O)~2~ Sb~2~ F~4~ O","Journal of Solid State Chemistry","1981","36","","214","220","10.1016/0022-4596(81)90159-6","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1008178","12.301","","7.102","","11.826","","90","","90.33","","90","","1033.1","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cobalt titanium selenide (.6/4/8)","","- Co0.555 Se8 Ti4 -","- Co0.555 Se8 Ti4 -","- Co2.22 Se32 Ti16 -","4","0.5","","Arnaud, Y; Chevreton, M","Etude structurale des composes Fe~0.25~ Ti Se~2~ et Co~0.25~ Ti Se~2~ a cristaux macles. Surstructures et degre d'ordre des lacunes","Journal of Solid State Chemistry","1981","36","","151","160","10.1016/0022-4596(81)90151-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1100019","4.9977","","4.9977","","5.4601","","90","","90","","120","","118.1","","","","","","","","","","","","","2","P 62 2 2","P 62 2 (0 0 4)","180","","Silicon oxide","Quartz high","- O2 Si -","- O2 Si -","- O6 Si3 -","3","0.25","","Wright, A F; Lehmann, M S","","Journal of Solid State Chemistry","1981","36","","371","380","10.1016/0022-4596(81)90449-7","","","","","","","","","","","","","","","","","","","","","has coordinates","278161","2022-09-26","15:29:28",""
"1509995","11.126","","11.126","","11.126","","90","","90","","90","","1377.26","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Ag9 Ga Se6 -","- Ag9 Ga Se6 -","- Ag36 Ga4 Se24 -","4","0.0416667","","Faure, R.; Deloume, J.P.","Un nouveau materiau, Ag9 Ga Se6: Etude structurale de la phase alpha","Journal of Solid State Chemistry","1981","36","","112","117","10.1016/0022-4596(81)90198-5","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523827","14.083","","14.486","","14.025","","90","","90","","90","","2861.19","","","","","","","","","","","","","2","I m m m","-I 2 2","71","","","","- Mg51.04 Zn19.8 -","- Mg51.04 Zn19.8 -","- Mg102.08 Zn39.6 -","2","0.125","","Higashi, I.; Shiotani, N.; Uda, M.; Mizoguchi, T.; Katoh, H.","The crystal structure of Mg51 Zn20","Journal of Solid State Chemistry","1981","36","","225","233","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527669","9.743","","5.622","","7.26","","90","","90.1","","90","","397.667","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Na Ba (P O4)","","- Ba Na O4 P -","- Ba Na O4 P -","- Ba4 Na4 O16 P4 -","4","0.5","","Kolsi, A.W.; Quarton, M.; Freundlich, W.","Structure cristalline de Na Ba P O4","Journal of Solid State Chemistry","1981","36","","107","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527789","9.515","","3.3412","","14.912","","90","","109.99","","90","","445.513","","","","","","","","","","","","","2","P 1 21/m 1","-P 2yb","11","","Ta S3","","- S3 Ta -","- S3 Ta -","- S18 Ta6 -","6","1.5","","Meerschaut, A.; Guemas, L.; Rouxel, J.","Structure and properties of the new phase of the pseudo one-dimensional compound Ta S3","Journal of Solid State Chemistry","1981","36","","118","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528166","18.334","","3.786","","14.044","","90","","115.2","","90","","882.052","","","","","","","","","","","","","2","P 1 2/m 1","-P 2y","10","","W18 O49","","- O49 W18 -","- O49 W18 -","- O49 W18 -","1","0.25","","Viswanathan, K.; Brandt, K.; Salje, E.","Crystal structure and charge carrier concentration of W18 O49","Journal of Solid State Chemistry","1981","36","","45","51","","","","","","","","","","","","","","","","","","","","","","has coordinates","150119","2020-10-21","18:00:00",""
"1534302","8.34","","13.11","","9.3","","90","","123.9","","90","","843.988","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se1.1 S6.9","","- S6.9 Se1.1 -","- S6.91 Se1.09 -","- S27.64 Se4.36 -","4","1","","Boudreau, R.A.; Haendler, H.M.","The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n","Journal of Solid State Chemistry","1981","36","","289","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","160860","2020-10-21","18:00:00",""
"1534303","8.4","","13.26","","9.37","","90","","124.5","","90","","860.114","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","Se3.7 S4.3","","- S4.35 Se3.55 -","- S4.35 Se3.55 -","- S17.4 Se14.2 -","4","1","","Boudreau, R.A.; Haendler, H.M.","The isostructural gamma-sulfur phase of selenium-sulfur, Sen S8-n","Journal of Solid State Chemistry","1981","36","","289","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","160861","2020-10-21","18:00:00",""
"1534354","5.6643","","14.6411","","3.9457","","90","","90","","90","","327.223","","","","","","","","","","","","","3","A 21 a m","A -2 2a","36","","La (Ta O4)","","- La O4 Ta -","- La O4 Ta -","- La4 O16 Ta4 -","4","0.5","","Cava, R.J.; Roth, R.S.","The structure of La Ta O4 by neutron powder profile analysis","Journal of Solid State Chemistry","1981","36","","139","147","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537387","10.747","","22.813","","7.602","","90","","90","","90","","1863.79","","","","","","","","","","","","","2","F d d d :1","F 2 2 -1d","70","","(Lu3 S4).75","","- Lu2.25 S3 -","- Lu2.27 S3 -","- Lu36.32 S48 -","16","0.5","","Hariharan, A.V.; Powell, D.R.; Jacobson, R.A.; Franzen, H.F.","The Crystal Structure of Lu3 S4: A New Population wave Structure","Journal of Solid State Chemistry","1981","36","","148","150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1539132","10.9597","","10.9597","","5.0774","","90","","90","","120","","528.165","","","","","","","","","","","","","3","P 3","P 3","143","","Co (I O3)2","","- Co I2 O6 -","- Co1.02925 I2 O6 -","- Co4.117 I8 O24 -","4","1.33333","","Svensson, C.; Abrahams, S.C.; Bernstein, J.L.","Crystal Structure and Pyroelectric Coefficient of Co (I O3)2 and Structural Relationships among the Anhydrous Noncentrosymmetric 3d-Transition Metal Iodates","Journal of Solid State Chemistry","1981","36","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539984","10.074","","4.2967","","16.172","","90","","90","","90","","700.004","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tl Mn I3","","- I3 Mn Tl -","- I3 Mn Tl -","- I12 Mn4 Tl4 -","4","0.5","","Zandbergen, H.W.","Neutron Powder Diffraction and Magnetic Measurements on Tl Mn I3 and Tl Fe I3","Journal of Solid State Chemistry","1981","36","","189","203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9012139","7.0138","","7.0138","","10.402","","90","","90","","90","","511.71","","","","","","","","","","","","Synthetic","3","P 4/m n c","-P 4 2n","128","","","Chiolite","- Al3 F14 Na5 -","- Al3 F14 Na5 -","- Al6 F28 Na10 -","2","0.125","","Jacoboni, C.; Leble, A.; Rousseau, J. J.","Determination precise de la structure de la chiolite Na5Al3F14 et etude par R.P.E. de Na5Al3F14:Cr3+","Journal of Solid State Chemistry","1981","36","","297","304","10.1016/0022-4596(81)90440-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""