# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T13:11:47+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 = 35 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
"1001106","18.371","0.006","3.794","0.001","9.199","0.003","90","","101.21","0.04","90","","628.9","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tripotassium pentatitanium niobium oxide","","- K3 Nb O14 Ti5 -","- K3 Nb O14 Ti5 -","- K6 Nb2 O28 Ti10 -","2","0.25","","Hervieu, M; Rebbah, A; Desgardin, G; Raveau, B","Layer Structure: The Oxides A~3~ Ti~5~ M O~14~","Journal of Solid State Chemistry","1980","35","","200","206","10.1016/0022-4596(80)90494-6","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001107","18.363","0.002","3.791","0.001","9.174","0.001","90","","101.28","0.01","90","","626.3","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tripotassium pentatitanium tantalum oxide","","- K3 O14 Ta Ti5 -","- K3 O14 Ta Ti5 -","- K6 O28 Ta2 Ti10 -","2","0.25","","Hervieu, M; Rebbah, A; Desgardin, G; Raveau, B","Layer Structure: The Oxides A~3~ Ti~5~ M O~14~","Journal of Solid State Chemistry","1980","35","","200","206","10.1016/0022-4596(80)90494-6","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001108","19.073","0.007","3.814","0.001","9.223","0.004","90","","100.93","0.04","90","","658.8","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Trirubidium pentatitanium niobium oxide","","- Nb O14 Rb3 Ti5 -","- Nb O14 Rb3 Ti5 -","- Nb2 O28 Rb6 Ti10 -","2","0.25","","Hervieu, M; Rebbah, A; Desgardin, G; Raveau, B","Layer Structuer: The Oxides A~3~ Ti~5~ M O~14~","Journal of Solid State Chemistry","1980","35","","200","206","10.1016/0022-4596(80)90494-6","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004052","9.75","","9.75","","9.75","","23.49","","23.49","","23.49","","129.3","","","","","","","","","","","","","3","R -3 m :R","-P 3* 2","166","","Bismuth strontium oxide (.8/.2/1.1)","","- Bi0.76 O1.11 Sr0.23 -","- Bi0.765 O1.11133 Sr0.235 -","- Bi2.295 O3.334 Sr0.705 -","3","0.25","","Conflant, P; Boivin, J C; Thomas, D","Etude structurale du conducteur anionique Bi~0.765~ Sr~0.235~ O~1.383~","Journal of Solid State Chemistry","1980","35","","192","199","10.1016/0022-4596(80)90493-4","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008916","6.528","0.001","4.217","0.001","6.435","0.001","90","","115.94","","90","","159.3","","","","","","","","","","","","","3","P 1 2 1","P 2y","3","","Potassium diytterbium fluoride - $-beta","","- F7 K Yb2 -","- F7 K Yb2 -","- F7 K Yb2 -","1","0.5","","le Fur, Y; Aleonard, S; Gorius, M F; Roux, M T","Structure cristalline de la phase $-beta-K Yb2 F7","Journal of Solid State Chemistry","1980","35","","29","33","10.1016/0022-4596(80)90459-4","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1527583","5.671","","5.671","","28.545","","90","","90","","120","","795.024","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba Co O2.6 -","- Ba Co O2.64333 -","- Ba12 Co12 O31.72 -","12","0.5","","Jacobson, A.J.; Hutchinson, J.L.","An investigation of the structure of 12H Ba Co O2.6 by electron microscopy and powder neutron diffraction","Journal of Solid State Chemistry","1980","35","","334","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527591","3.938","","3.938","","9.469","","90","","90","","90","","146.844","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Eu Ni2 P2 -","- Eu Ni2 P2 -","- Eu2 Ni4 P4 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-Nickel-Phosphides with Th Cr2 Si2-Type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527619","13.551","","7.482","","6.515","","90","","106.12","","90","","634.575","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Na3 Fe (C N)6 (H2 O)2","","- C6 H4 Fe N6 Na3 O2 -","- C6 H4 Fe N6 Na3 O2 -","- C12 H8 Fe2 N12 Na6 O4 -","2","0.25","","Katila, T.; Ylae-Jaeaeski, J.; Leskelae, M.; Niinisto, L.; Riski, K.J.; Valkonen, J.","Crystal structure and Moessbauer measurements of monoclinic sodium hexacyanoferrate(III) dihydrate","Journal of Solid State Chemistry","1980","35","","341","346","","","","","","","","","","","","","","","","","","","","","","has coordinates","186638","2020-10-21","18:00:00",""
"1527714","13.95","","3.762","","8.352","","90","","90","","90","","438.312","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","Gd3 O (O H)5 Br2","","- Br2 Gd3 H5 O6 -","- Br2 Gd3 O6 -","- Br4 Gd6 O12 -","2","0.25","","Lance-Gomez, E.T.; Haschke, J.M.","Phase equilibria of the oxide hydroxide halide systems of Sm, Eu, and Gd. The crystal structure of Gd3 O (O H)5 Br2","Journal of Solid State Chemistry","1980","35","","357","366","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528241","8.19","","8.19","","6.958","","90","","90","","120","","404.187","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cs Mn I3","","- Cs I3 Mn -","- Cs I3 Mn -","- Cs2 I6 Mn2 -","2","0.0833333","","Zandbergen, H.W.","Neutron powder diffraction and magnetic measurements on Cs Mn I3","Journal of Solid State Chemistry","1980","35","","367","375","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528418","16.06","","7.26","","8.863","","90","","90","","90","","1033.39","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- Ba5 Fe4 S11 -","- Ba5 Fe4 S11 -","- Ba10 Fe8 S22 -","2","0.5","","Cohen, S.; Kimizuka, N.; Steinfink, H.","The Crystal Structure and Stability of Ba5 Fe4 S11","Journal of Solid State Chemistry","1980","35","","181","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528728","9.827","","9.827","","7.304","","90","","90","","120","","610.848","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb8 K2 (P O4)6","","- K2 O24 P6 Pb8 -","- K2.042 O24 P6 Pb7.998 -","- K2.042 O24 P6 Pb7.998 -","1","0.0833333","","Mathew, M.; Brown, W.E.; Austin, M.; Negas, T.","Lead alkali apatites without hexad anion: The crystal structure of Pb8 K2 (P O4)6","Journal of Solid State Chemistry","1980","35","","69","76","","","","","","","","","","","","","","","","","","","","","","has coordinates","151333","2020-10-21","18:00:00",""
"1528916","11.473","","11.473","","5.208","","90","","90","","90","","685.528","","","","","","","","","","","","","2","I -4 2 d","I -4 2bw","122","","U F5","","- F5 U -","- F5 U -","- F40 U8 -","8","0.5","","Taylor, J.C.; Waugh, A.B.","Neutron diffraction study of beta-uranium pentafluoride between 77 and 403 K","Journal of Solid State Chemistry","1980","35","","137","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528924","5.885","","5.885","","14.627","","90","","90","","120","","438.711","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba3 Y Ir2 O9","","- Ba3 Ir2 O9 Y -","- Ba3 Ir2 O9 Y -","- Ba6 Ir4 O18 Y2 -","2","0.0833333","","Thumm, I.; Kemmler-Sack, S.; Treiber, U.","Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium. Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9","Journal of Solid State Chemistry","1980","35","","156","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528925","5.925","","5.925","","14.785","","90","","90","","120","","449.499","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba3 Sm Ir2 O9","","- Ba3 Ir2 O9 Sm -","- Ba3 Ir2 O9 Sm -","- Ba6 Ir4 O18 Sm2 -","2","0.0833333","","Thumm, I.; Treiber, U.; Kemmler-Sack, S.","Ueber Sauerstoffperowskite mit fuenf- und vierwertigem Iridium. Verbindungen vom Typ Ba2 B(3+) Ir(5+) O6 und Ba3 B(3+) Ir2(4,5+) O9","Journal of Solid State Chemistry","1980","35","","156","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535868","9.895","","9.895","","9.895","","90","","90","","90","","968.83","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Ga0.667 Cr2 S4","","- Cr2 Ga0.667 S4 -","- Cr2 Ga0.667 S4 -","- Cr16 Ga5.336 S32 -","8","0.0416667","","Nakatani, I.","Crystallographic and magnetic studies of cation-deficient spinels M2/3+x Cr2-x S4 (M = Al; Ga; In)","Journal of Solid State Chemistry","1980","35","","50","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1535870","9.893","","9.893","","9.893","","90","","90","","90","","968.242","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Al0.667 (Al0.333 Cr1.667) S4","","- Al Cr1.667 S4 -","- Al1.001 Cr1.667 S4 -","- Al8.008 Cr13.336 S32 -","8","0.0416667","","Nakatani, I.","Crystallographic and magnetic studies of cation-deficient spinels M2/3+x Cr2-x S4 (M = Al; Ga; In)","Journal of Solid State Chemistry","1980","35","","50","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537777","10.967","","10.967","","10.967","","90","","90","","90","","1319.06","","","","","","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","","Mg Yb2 S4","","- Mg S4 Yb2 -","- Mg0.999 S4 Yb2.001 -","- Mg3.996 S16 Yb8.004 -","4","0.0833333","","Ben-Dor, L.; Shilo, I.","Structure and magnetic properties of sulfides of the type Cd RE2 S4 and Mg (Gdx Yb1-x)2 S4","Journal of Solid State Chemistry","1980","35","","278","285","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538578","4.007","","4.007","","9.632","","90","","90","","90","","154.652","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- La Ni2 P2 -","- La Ni2 P2 -","- La2 Ni4 P4 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538580","3.952","","3.952","","9.493","","90","","90","","90","","148.265","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ni2 Pr P2","","- Ni2 P2 Pr -","- Ni2 P2 Pr -","- Ni4 P4 Pr2 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538582","3.919","","3.919","","9.403","","90","","90","","90","","144.417","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ni2 Sm P2","","- Ni2 P2 Sm -","- Ni2 P2 Sm -","- Ni4 P4 Sm2 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538584","3.823","","3.823","","9.31","","90","","90","","90","","136.069","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ni2 Tm P2","","- Ni2 P2 Tm -","- Ni2 P2 Tm -","- Ni4 P4 Tm2 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538586","3.859","","3.859","","9.332","","90","","90","","90","","138.971","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ni2 Y P2","","- Ni2 P2 Y -","- Ni2 P2 Y -","- Ni4 P4 Y2 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540175","3.942","","3.942","","9.461","","90","","90","","90","","147.018","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Nd Ni2 P2 -","- Nd Ni2 P2 -","- Nd2 Ni4 P4 -","2","0.0625","","Jeitschko, W.; Jaberg, B.","Lanthanoid-nickel-phosphides with ThCr2Si2-type structure","Journal of Solid State Chemistry","1980","35","","312","317","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"9009751","5.535","","11.3991","","5.159","","90","","94.6","","90","","324.454","","","","","","","","","","","","Synthetic","3","I 1 2/a 1","-I 2ya","15","","","Beta - fergusonite-(Ce)","- Ce Nb O4 -","- Ce Nb O4 -","- Ce4 Nb4 O16 -","4","0.5","","Santoro A; Marezio M; Roth R S; Minor D","Neutron powder diffraction study of the structures of CeTaO4, CeNbO4, and NdTaO4","Journal of Solid State Chemistry","1980","35","","167","175","10.1016/0022-4596(80)90489-2","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009752","7.6161","","5.5254","","7.7588","","90","","100.87","","90","","320.648","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Ce O4 Ta -","- Ce O4 Ta -","- Ce4 O16 Ta4 -","4","1","","Santoro, A.; Marezio, M.; Roth, R. S.; Minor, D.","Neutron powder diffraction study of the structures of CeTaO4, CeNbO4, and NdTaO4","Journal of Solid State Chemistry","1980","35","","167","175","10.1016/0022-4596(80)90489-2","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009753","5.5115","","11.232","","5.1112","","90","","95.71","","90","","314.84","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","","- Nd O4 Ta -","- Nd O4 Ta -","- Nd4 O16 Ta4 -","4","0.5","","Santoro, A.; Marezio, M.; Roth, R. S.; Minor, D.","Neutron powder diffraction study of the structures of CeTaO4, CeNbO4, and NdTaO4","Journal of Solid State Chemistry","1980","35","","167","175","10.1016/0022-4596(80)90489-2","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9013959","3.021","","10.009","","12.643","","90","","90","","90","","382.289","","","","","","","","","","","","Synthetic","3","C m c m","-C 2c 2","63","","","","- Ca Fe3 O5 -","- Ca Fe3 O5 -","- Ca4 Fe12 O20 -","4","0.25","","Evrard, O.; Malaman, B.; Jeannot, F.; Courtois, A.; Alebouyeh, H.; Gerardin, R.","Mise en evidence de CaFe4O6 et determination des structures cristalline des ferrites de calcium CaFe2+nO4+n (n=1,2,3): nouvel exemple d'intercroissance","Journal of Solid State Chemistry","1980","35","","112","119","10.1016/0022-4596(80)90471-5","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9013960","3.05","","9.986","","15.321","","90","","90","","90","","466.636","","","","","","","","","","","","Synthetic","3","C m c m","-C 2c 2","63","","","","- Ca Fe4 O6 -","- Ca Fe4 O6 -","- Ca4 Fe16 O24 -","4","0.25","","Evrard, O.; Malaman, B.; Jeannot, F.; Courtois, A.; Alebouyeh, H.; Gerardin, R.","Mise en evidence de CaFe4O6 et determination des structures cristalline des ferrites de calcium CaFe2+nO4+n (n=1,2,3): nouvel exemple d'intercroissance","Journal of Solid State Chemistry","1980","35","","112","119","10.1016/0022-4596(80)90471-5","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9013961","3.052","","10.041","","17.966","","90","","90","","90","","550.57","","","","","","","","","","","","Synthetic","3","C m c m","-C 2c 2","63","","","","- Ca Fe5 O7 -","- Ca Fe5 O7 -","- Ca4 Fe20 O28 -","4","0.25","","Evrard, O.; Malaman, B.; Jeannot, F.; Courtois, A.; Alebouyeh, H.; Gerardin, R.","Mise en evidence de CaFe4O6 et determination des structures cristalline des ferrites de calcium CaFe2+nO4+n (n=1,2,3): nouvel exemple d'intercroissance","Journal of Solid State Chemistry","1980","35","","112","119","10.1016/0022-4596(80)90471-5","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""