# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-11T11:47:50+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'A m m a' 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
"1529540","13.616","","17.158","","16.681","","90","","90","","90","","3897.07","","","","","","","","","","","","","6","A m m a","-A 2a 2a","63","","Na0.384 Ca2.816 H1.94 (Si28.044 Al7.956 O72) (H2 O)1.28","","- Al7.956 Ca2.816 H4.5 Na0.384 O73.28 Si28.044 -","- Al7.956 Ca2.816 Na0.384 O73.28 Si28.044 -","- Al15.912 Ca5.632 Na0.768 O146.56 Si56.088 -","2","0.125","","Alberti, A.; Rinaldi, R.; Vezzalini, G.","Dynamics of dehydration in stilbite-type structures; stellerite phase B","Physics and Chemistry of Minerals (Germany)","1978","2","","365","375","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2105046","5.351","0.0006","26.669","0.003","5.4914","0.0006","90","","90","","90","","783.65","0.15","298","","298","","","","","","","","","5","A m m a","-A 2a 2a","63","","","","- Ca4 Fe2 Mn0.5 O9 Ti0.5 -","- Ca4 Fe2.498 O9 Ti0.502 -","- Ca16 Fe9.992 O36 Ti2.008 -","4","0.25","SN5108","Krüger, H.; Stöber, S.; Welberry, T. R.; Withers, R. L.; Fitz Gerald, J. D.","Stacking faults and superstructures in a layered brownmillerite","Acta Crystallographica Section B","2011","67","6","476","485","10.1107/S0108768111042005","","","0.71073","MoKα","","0.0253","0.0231","","","0.033","0.0336","","","","","","2.61","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2310506","28.5","","3.805","","20.51","","90","","90","","90","","2224.16","","","","","","","","","","","","","3","A m m a","-A 2a 2a","63","","Ti2 Nb10 O29","","- Nb10 O29 Ti2 -","- Nb9.996 O29 Ti2.004 -","- Nb39.984 O116 Ti8.016 -","4","0.25","","Wadsley, A.D.","Mixed oxides of titanium and niobium. II. The crystal structures of the dimorphic forms of Ti2 Nb10 O29","Acta Crystallographica (1,1948-23,1967)","1961","14","","664","670","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"3000391","13.6684","0.0003","17.869","0.0004","17.6896","0.0004","90","","90","","90","","4320.52","0.17","398","2","398","2","","","","","","","","3","A m m a","-A 2a 2a","","Pb-stellerite","","","- O167.88 Pb11.42 Si72 -","","","","","","Cametti, Georgia; Roos, Diana; Prieur, Damien; Scheinost, Andreas; Churakov, Sergey","","To be published in Scientific Reports","","","","","","","","","0.71073","MoKα","","0.1277","0.0931","","","0.2432","0.2647","","","","","","1.035","","","","","276105","2022-06-20","14:38:14","2022-11-20"
"4001906","28.7093","0.0006","3.82563","0.00007","20.6241","0.0004","90","","90","","90","","2265.17","0.08","","","","","","","","","","","","3","A m m a","-A 2a 2a","63","","","","- Fe Nb11 O29 -","- Fe Nb11 O29 -","- Fe4 Nb44 O116 -","4","0.25","","Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M.","Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications","Chemistry of Materials","2014","26","6","2203","","10.1021/cm500442j","powder diffraction","","","","","","","","","","","","","1.44","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001907","28.4036","0.0004","4.08447","0.00008","20.70671","0.00019","90","","90","","90","","2402.26","0.06","","","","","","","","","","","","4","A m m a","-A 2a 2a","63","","","","- Fe Li11 Nb11 O29 -","- Fe0.996 Li11 Nb11.004 O29 -","- Fe3.984 Li44 Nb44.016 O116 -","4","0.25","","Pinus, Ilya; Catti, Michele; Ruffo, Riccardo; Salamone, Matteo M.; Mari, Claudio M.","Neutron Diffraction and Electrochemical Study of FeNb11O29/Li11FeNb11O29for Lithium Battery Anode Applications","Chemistry of Materials","2014","26","6","2203","","10.1021/cm500442j","powder diffraction","neutron","","","","","","","","","","0.09172","","2.23","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4345503","6.7876","0.0014","7.3532","0.0015","17.718","0.004","90","","90","","90","","884.3","0.3","293","2","293","2","","","","","","","","5","A m m a","-A 2a 2a","63","","","","- C5 H6 Cd Cl3 N -","- C5 H6 Cd Cl3 N -","- C20 H24 Cd4 Cl12 N4 -","4","0.25","","Sun, Xiao-Fen; Wang, Zhongxia; Li, Peng-Fei; Liao, Wei-Qiang; Ye, Heng-Yun; Zhang, Yi","Tunable Dielectric Responses Triggered by Dimensionality Modification in Organic-Inorganic Hybrid Phase Transition Compounds (C5H6N)CdnCl2n+1 (n = 1 and 2).","Inorganic chemistry","2017","56","6","3506","3511","10.1021/acs.inorgchem.6b03074","","","0.71073","MoKα","","0.0544","0.0519","","","0.1153","0.1171","","","","","","1.111","","","","has coordinates","194820","2020-10-21","18:00:00",""
"5000040","6.991","","6.996","","6.238","","90","","90","","90","","305.1","","","","","","","","","","","","Madagascar","3","A m m a","-A 2a 2a","63","","Calcium sulfate","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Cheng, G C H; Zussman, J","The crystal structure of anhydrite (Ca S O4)","Acta Crystallographica (1,1948-23,1967)","1963","16","","767","769","10.1107/S0365110X63001997","","","","","","0.11","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:29",""
"9001865","13.72","","17.6808","","17.4461","","90","","90","","90","","4232.08","","","","441","","","","","","","","","6","A m m a","-A 2a 2a","63","","","Stilbite-Ca","- Al0.72 Ca0.12 H0.333 Na0.068 O6.69 Si2.28 -","- Al0.72 Ca0.12 H1.38 Na0.0683333 O6.69 Si2.28 -","- Al17.28 Ca2.88 H33.12 Na1.64 O160.56 Si54.72 -","24","1.5","","Cruciani, G.; Artioli, G.; Gualtieri, A.; Stahl, K.; Hanson, J. C.","Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction Sample: at T = 441 K","American Mineralogist","1997","82","","729","739","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:44",""
"9001866","13.5849","","17.6213","","17.1148","","90","","90","","90","","4097","","","","521","","","","","","","","","6","A m m a","-A 2a 2a","63","","","Stilbite-Ca","- Al3.12 Ca0.4 H1.96 Na0.235 O19.3 Si9.88 -","- Al3.12 Ca0.4 H1.46 Na0.235 O19.3 Si9.88 -","- Al24.96 Ca3.2 H11.68 Na1.88 O154.4 Si79.04 -","8","0.5","","Cruciani, G.; Artioli, G.; Gualtieri, A.; Stahl, K.; Hanson, J. C.","Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction Sample: at T = 521 K","American Mineralogist","1997","82","","729","739","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:12",""
"9004017","13.6629","","17.6064","","17.3629","","90","","90","","90","","4176.72","","","","503","","","","","","","","Seremida, Sardinia, Italy","6","A m m a","-A 2a 2a","63","","","Stellerite","- Al3.96 Ca1.46 H6.796 Na0.19 O37.97 Si15.84 -","- Al3.96 Ca1.46 H3.94 Na0.19 O37.97 Si15.84 -","- Al15.84 Ca5.84 H15.76 Na0.76 O151.88 Si63.36 -","4","0.25","","Arletti, R.; Mazzucato, E.; Vezzalini, G.","Influence of dehydration kinetics on T-O-T bridge breaking in zeolites with framework type STI: The case of stellerite Sample: T = 503 K Note: occupancies invented to match formula","American Mineralogist","2006","91","","628","634","10.2138/am.2006.1966","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:08",""
"9004018","13.5426","","17.557","","17.102","","90","","90","","90","","4066.3","","","","740","","","","","","","","Seremida, Sardinia, Italy","6","A m m a","-A 2a 2a","63","","","Stellerite","- Al3.56 Ca1.14 H0.88 Na0.14 O38.13 Si15.84 -","- Al3.56 Ca1.14 H1.22 Na0.14 O38.13 Si15.84 -","- Al14.24 Ca4.56 H4.88 Na0.56 O152.52 Si63.36 -","4","0.25","","Arletti, R.; Mazzucato, E.; Vezzalini, G.","Influence of dehydration kinetics on T-O-T bridge breaking in zeolites with framework type STI: The case of stellerite Sample: T = 740 K Note: occupancies invented to match formula","American Mineralogist","2006","91","","628","634","10.2138/am.2006.1966","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:08",""
"9004096","6.993","","6.995","","6.245","","90","","90","","90","","305.481","","","","","","","","","","","","Leopoldshall, East Germany","3","A m m a","-A 2a 2a","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Hawthorne, F. C.; Ferguson, R. B.","Anhydrous sulphates. II. Refinement of the crystal structure of anhydrite","The Canadian Mineralogist","1975","13","","289","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9005756","13.62","","17.16","","16.68","","90","","90","","90","","3898.44","","","","","","","","","","","","","8","A m m a","-A 2a 2a","63","","","Stellerite","- Al3.978 Ca1.389 H2.8 K0.014 Mg0.008 Na0.189 O36.64 Si14.022 -","- Al3.978 Ca1.3888 H1.28 K0.0144 Mg0.008 Na0.1888 O36.64 Si14.022 -","- Al15.912 Ca5.5552 H5.12 K0.0576 Mg0.032 Na0.7552 O146.56 Si56.088 -","4","0.25","","Alberti, A.; Rinaldi, R.; Vezzalini, G.","Dynamics of dehydration in stilbite-type structures; stellerite phase B Sample: Stellerite phase B","Physics and Chemistry of Minerals","1978","2","","365","375","10.1007/BF00307578","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:21",""
"9009956","13.598","","18.177","","17.79","","90","","90","","90","","4397.17","","","","","","","","","","","","Kuiu Island, Alaska, USA","7","A m m a","-A 2a 2a","63","","","Barrerite","- Al3.974 Ca0.56 H56 K0.864 Na2.476 O47.17 Si14.026 -","- Al3.9744 Ca0.56 H22.34 K0.864 Na2.476 O47.17 Si14.0256 -","- Al15.8976 Ca2.24 H89.36 K3.456 Na9.904 O188.68 Si56.1024 -","4","0.25","","Sacerdoti, M.; Sani, A.; Vezzalini, G.","Structural refinement of two barrerites from Alaska Note: sample 1","Microporous and Mesoporous Materials","1999","30","","103","109","10.1016/S1387-1811(99)00028-1","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9009957","13.586","","18.184","","17.812","","90","","90","","90","","4400.42","","","","","","","","","","","","Kuiu Island, Alaska, USA","7","A m m a","-A 2a 2a","63","","","Barrerite","- Al3.974 Ca0.97 H58 K1.68 Na2.79 O46.3 Si14.026 -","- Al3.9744 Ca0.97 H20.6 K1.68 Na2.79 O46.3 Si14.0256 -","- Al15.8976 Ca3.88 H82.4 K6.72 Na11.16 O185.2 Si56.1024 -","4","0.25","","Sacerdoti, M.; Sani, A.; Vezzalini, G.","Structural refinement of two barrerites from Alaska Note: sample 3","Microporous and Mesoporous Materials","1999","30","","103","109","10.1016/S1387-1811(99)00028-1","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9013286","13.6336","","18.2056","","17.8445","","90","","90","","90","","4429.15","","","","339","","","","","","","","Kuiu Island, Alaska","8","A m m a","-A 2a 2a","63","","","Barrerite","- Al4.158 Ca0.492 H46 K0.797 Mg0.069 Na1.981 O45.6 Si13.842 -","- Al4.158 Ca0.492 H19.2 K0.797 Mg0.069 Na1.981 O45.6 Si13.842 -","- Al16.632 Ca1.968 H76.8 K3.188 Mg0.276 Na7.924 O182.4 Si55.368 -","4","0.25","","Ori, S.; Mazzucato, E.; Vezzalini, G.","Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 339 K","American Mineralogist","2009","94","","64","73","10.2138/am.2009.2914","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9013287","13.6744","","17.8937","","17.5723","","90","","90","","90","","4299.69","","","","482","","","","","","","","Kuiu Island, Alaska","8","A m m a","-A 2a 2a","63","","","Barrerite","- Al2.079 Ca0.246 H8.28 K0.398 Mg0.035 Na0.986 O20.38 Si6.921 -","- Al2.079 Ca0.246 H4.76 K0.3985 Mg0.035 Na0.9865 O20.38 Si6.921 -","- Al16.632 Ca1.968 H38.08 K3.188 Mg0.28 Na7.892 O163.04 Si55.368 -","8","0.5","","Ori, S.; Mazzucato, E.; Vezzalini, G.","Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-A, T = 482 K","American Mineralogist","2009","94","","64","73","10.2138/am.2009.2914","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59",""
"9013288","13.5502","","17.1487","","16.0919","","90","","90","","90","","3739.25","","","","637","","","","","","","","Kuiu Island, Alaska","8","A m m a","-A 2a 2a","63","","","Barrerite","- Al4.158 Ca0.498 H12.5 K0.792 Mg0.07 Na1.975 O37.85 Si13.842 -","- Al4.158 Ca0.498 H3.86 K0.792 Mg0.07 Na1.975 O37.85 Si13.842 -","- Al16.632 Ca1.992 H15.44 K3.168 Mg0.28 Na7.9 O151.4 Si55.368 -","4","0.25","","Ori, S.; Mazzucato, E.; Vezzalini, G.","Dehydration dynamics of barrerite: An in situ synchrotron XRPD study Note: BAR-B, T = 637 K","American Mineralogist","2009","94","","64","73","10.2138/am.2009.2914","","","","","","","","","","","","","","","","","","","","","has coordinates","288346","2023-12-15","16:10:05",""
"9017312","7.006","","6.998","","6.245","","90","","90","","90","","306.18","","","","","","","","","","","","Stassfurt, Germany","3","A m m a","-A 2a 2a","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Kirfel, A.; Will, G.","Charge density in anhydrite, CaSO4, from X-ray and neutron diffraction measurements","Acta Crystallographica, Section B","1980","36","","2881","2890","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017809","7.00032","","6.99234","","6.24097","","90","","90","","90","","305.487","","","","","","","","","","","","Hants County, Nova Scotia, Canada","3","A m m a","-A 2a 2a","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Antao, S.","Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data","Powder Diffraction","2011","26","","326","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017810","7.00071","","6.99274","","6.24125","","90","","90","","90","","305.535","","","","","","","","","","","","","3","A m m a","-A 2a 2a","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Antao, S.","Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data","Powder Diffraction","2011","26","","326","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017811","7.00136","","6.99339","","6.24171","","90","","90","","90","","305.614","","","","","","","","","","","","","3","A m m a","-A 2a 2a","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Antao, S.","Crystal-structure analysis of four mineral samples of anhydrite, Ca(SO4), using synchrotron high-resolution powder X-ray diffraction data","Powder Diffraction","2011","26","","326","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""