# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-20T19:12:34+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P m a 2' 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
"1007179","27.88","0.1","7.536","0.005","7.378","0.005","90","","90","","90","","1550.1","","","","","","","","","","","","","5","P m a 2","P 2 -2a","28","","Calcium disodium cyclo-tetraphosphate 5.5-hydrate","","- Ca H11 Na2 O17.5 P4 -","- Ca H11 Na2 O17.5 P4 -","- Ca4 H44 Na8 O70 P16 -","4","1","","Averbuch-Pouchot, M T; Durif, A","Crystal structures of two new types of cyclo-tetraphosphates: tetracalcium tetrapotassium tris(cyclo-tetraphosphate) octahydrate and calcium disodium cyclo-tetraphosphate 5.5-hydrate","Acta Crystallographica C (39,1983-)","1988","44","","212","216","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1011091","16.50999","0.03","8.8","0.03","4.45","0.03","90","","90","","90","","646.5","","","","","","","","","","","","from Cripple Creek, Colorado","2","P m a 2","P 2 -2a","28","","Gold(IV) telluride","Krennerite","- Au Te2 -","- Au Te2 -","- Au8 Te16 -","8","2","","Tunell, G; Ksanda, C J","The crystal structure of Krennerite","Journal of the Washington Academy of Sciences","1936","26","","507","527","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1533594","7.5382","","3.7879","","6.0647","","90","","90","","90","","173.171","","","","","","","","","","","","","2","P m a 2","P 2 -2a","28","","","","- Ni2.88 Te2 -","- Ni2.88 Te2 -","- Ni5.76 Te4 -","2","0.5","","Gulay, L.D.; Olekseyuk, I.D.","Crystal structures of the compounds Ni3 Te2, Ni3-d Te2 (d = 0.12) and Ni1.29 Te","Journal of Alloys Compd.","2004","376","","131","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1544600","18.487","0.0001","5.4801","0.0003","4.6306","0.0003","90","","90","","90","","469.13","0.04","","","","","","","","","","","","6","P m a 2","P 2 -2a","28","Ca2Al1.84Fe0.16Si3O10(OH)2 prehnite","","ferrian prehnite","- Al1.84 Ca2 Fe0.16 H2 O12 Si3 -","- Al1.8 Ca2 Fe0.2 O12 Si3 -","- Al3.6 Ca4 Fe0.4 O24 Si6 -","2","0.5","","Akasaka, M.; Hashimoto, H.; Makino, K.; Hino, R.","57Fe Mossbauer and X-ray Rietveld studies of ferrian prehnite from Kouragahara, Shimane Peninsula, Japan : Model Pma2","Journal of Mineralogical and Petrological Sciences","2003","98","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","188540","2020-10-21","18:00:00",""
"1564252","18.6149","0.001","5.4882","0.0003","4.6735","0.0003","90","","90","","90","","477.46","0.05","","","298","","","","100","","","","","6","P m a 2","P 2 -2a","28","Ca1.99(Fe0.66Al0.34)(Al1.02Si2.98)O10(OH)2","","ferriprehnite","- Al1.36 Ca1.99 Fe0.66 H2 O12 Si2.98 -","- Al1.363 Ca2 Fe0.637 H2 O12 Si3 -","- Al2.726 Ca4 Fe1.274 H4 O24 Si6 -","2","0.5","","Nagashima, M.; Nishio-Hamane, D.; Ito, S.; Tanaka, T.","Ferriprehnite, Ca2Fe3+(AlSi3)O10(OH)2, an Fe3+ analogue of prehnite, from Kouragahana, Shimane Prefecture, Japan : ferriprehnite","Journal of Mineralogical and Petrological Sciences","2021","116","","129","139","10.2465/jmps.210127","","","","","","","","","","","","","","","","","","","","","has coordinates","267767","2021-07-27","22:14:34",""
"1564253","18.4626","0.0004","5.4793","0.0001","4.6201","0.0001","90","","90","","90","","467.379","0.017","","","298","","","","100","","","","","6","P m a 2","P 2 -2a","28","Ca1.98Mn0.01Al1.00(Al1.01Si2.99)O10(OH)2","","ferriprehnite","- Al2.01 Ca1.98 H2 Mn0.01 O12 Si2.99 -","- Al2 Ca2 H2 O12 Si3 -","- Al4 Ca4 H4 O24 Si6 -","2","0.5","","Nagashima, M.; Nishio-Hamane, D.; Ito, S.; Tanaka, T.","Ferriprehnite, Ca2Fe3+(AlSi3)O10(OH)2, an Fe3+ analogue of prehnite, from Kouragahana, Shimane Prefecture, Japan : prehnite from N'Chwaning mine","Journal of Mineralogical and Petrological Sciences","2021","116","","129","139","10.2465/jmps.210127","","","","","","","","","","","","","","","","","","","","","has coordinates","267768","2021-07-27","22:16:25",""
"1564254","18.503","0.0006","5.4814","0.0001","4.6346","0.0001","90","","90","","90","","470.05","0.02","","","298","","","","100","","","","","7","P m a 2","P 2 -2a","28","Ca1.99(Al0.81Fe0.17V0.01)(Al1.00Si3.00)O10(OH)2","","ferriprehnite","- Al1.81 Ca1.99 Fe0.17 H2 O12 Si3 V0.01 -","- Al1.845 Ca2 Fe0.155 H2 O12 Si3 -","- Al3.69 Ca4 Fe0.31 H4 O24 Si6 -","2","0.5","","Nagashima, M.; Nishio-Hamane, D.; Ito, S.; Tanaka, T.","Ferriprehnite, Ca2Fe3+(AlSi3)O10(OH)2, an Fe3+ analogue of prehnite, from Kouragahana, Shimane Prefecture, Japan : prehnite from Sekigawa with some iron3+","Journal of Mineralogical and Petrological Sciences","2021","116","","129","139","10.2465/jmps.210127","","","","","","","","","","","","","","","","","","","","","has coordinates","267769","2021-07-27","22:17:27",""
"2310717","5.175","","6.092","","5.488","","90","","90","","90","","173.015","","","","","","","","","","","","","2","P m a 2","P 2 -2a","28","","Tl F","","- F Tl -","- F Tl -","- F4 Tl4 -","4","1","","Alcock, N.W.","The crystal structure of thallous fluoride","Acta Crystallographica A (24,1968-38,1982)","1969","25","","S101","S101","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"3000360","4.966","0.013","5.157","0.006","3.5478","0.0019","90","","90","","90","","90.9","0.3","293","2","293","2","","","","","","","","2","P m a 2","P 2 -2a","","CeZn","Cerium Zinc","","- Ce Zn -","","","","","","X.-L. Shen; H. Ma; Dilip Bhoi; J. Gouchi; Y. Uwatoko; A. Dalan; Y. Kawamura; H. Sato; I. Umehara; M. Uehara","Pressure induced superconductivity and multiple structural transitions in CsCl-type cubic CeZn single crystal","To be published in Crystals","","","","","","","","x-ray","0.71073","MoKα","","0.1242","0.1114","","","0.2608","0.2833","","","","","","1.285","","","","","274554","2022-04-15","10:21:39","2023-09-15"
"4104442","24.7573","0.0011","5.6223","0.0002","3.8806","0.0002","90","","90","","90","","540.15","0.04","296","2","296","2","","","","","","","","3","P m a 2","P 2 -2a","28","","","","- C12 H12 O5 -","- C12 H12 O5 -","- C24 H24 O10 -","2","0.5","","Shi-Yao Yang; Panče Naumov; Shunichi Fukuzumi","Topochemical Limits for Solid-State Photoreactivity by Fine Tuning of the π-π Interactions","Journal of the American Chemical Society","2009","131","","7247","7249","10.1021/ja902094b","","","0.71073","MoKα","","0.0344","0.0297","","","0.0711","0.0742","","","","","","1.085","","","","has coordinates","178790","2020-10-21","18:00:00",""
"4126953","14.268","0.005","6.442","0.002","6.451","0.002","90","","90","","90","","592.9","0.3","300","","300","","","","","","","","","5","P m a 2","P 2 -2a","28","","","","- C4 H12 Cl4 Fe N -","- C4 H12 Cl4 Fe N -","- C8 H24 Cl8 Fe2 N2 -","2","0.5","","Harada, Jun; Yoneyama, Naho; Yokokura, Seiya; Takahashi, Yukihiro; Miura, Atsushi; Kitamura, Noboru; Inabe, Tamotsu","Ferroelectricity and Piezoelectricity in Free-Standing Polycrystalline Films of Plastic Crystals.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b10539","","","0.71073","MoKα","","0.0249","0.0246","","","0.0714","0.072","","","","","","1.089","","","","has coordinates,has disorder","204641","2020-10-21","18:00:00",""
"4134253","14.8771","0.0009","9.4425","0.0005","5.8322","0.0004","90","","90","","90","","819.29","0.09","293","2","293","2","","","","","","","","5","P m a 2","P 2 -2a","28","","","","- C5 H16 Cl6 N2 Pb2 -","- C5 H16 Cl6 N2 Pb2 -","- C10 H32 Cl12 N4 Pb4 -","2","0.5","","Zhang, Han-Yue; Song, Xian-Jiang; Cheng, Hao; Zeng, Yu-Ling; Zhang, Yi; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen","A Three-Dimensional Lead Halide Perovskite-Related Ferroelectric.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c00375","","","0.71073","MoKα","","0.0585","0.0545","","","0.152","0.1569","","","","","","1.003","","","","has coordinates","248459","2020-10-21","18:00:00",""
"4134254","14.9094","0.0006","9.4872","0.0004","5.8622","0.0003","90","","90","","90","","829.2","0.06","393","2","393","2","","","","","","","","5","P m a 2","P 2 -2a","28","","","","- C5 H16 Cl6 N2 Pb2 -","- C5 H16 Cl6 N2 Pb2 -","- C10 H32 Cl12 N4 Pb4 -","2","0.5","","Zhang, Han-Yue; Song, Xian-Jiang; Cheng, Hao; Zeng, Yu-Ling; Zhang, Yi; Li, Peng-Fei; Liao, Wei-Qiang; Xiong, Ren-Gen","A Three-Dimensional Lead Halide Perovskite-Related Ferroelectric.","Journal of the American Chemical Society","2020","","","","","10.1021/jacs.0c00375","","","0.71073","MoKα","","0.0388","0.0358","","","0.091","0.0925","","","","","","1.004","","","","has coordinates","248460","2020-10-21","18:00:00",""
"4340131","29.177","0.005","10.248","0.005","11.658","0.005","90","0.005","90","0.005","90","0.005","3486","2","100","2","100","2","","","","","","","","5","P m a 2","P 2 -2a","28","","","","- C19.5 H12.5 N3 O4 Zn -","- C19.5 H12.5 N3 O4 Zn -","- C78 H50 N12 O16 Zn4 -","4","1","","Sen, Susan; Neogi, Subhadip; Aijaz, Arshad; Xu, Qiang; Bharadwaj, Parimal K.","Construction of non-interpenetrated charged metal-organic frameworks with doubly pillared layers: pore modification and selective gas adsorption.","Inorganic chemistry","2014","53","14","7591","7598","10.1021/ic500900n","","","0.71069","MoKα","","0.1025","0.0835","","","0.2219","0.2315","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"8106293","6.7623","0.0002","21.1431","0.0006","8.8708","0.0002","90","","90","","90","","1268.31","0.06","200","2","200","2","","","","","","","","4","P m a 2","P 2 -2a","28","","","","- C13 H14 Cl N3 -","- C13 H13.75 Cl N3 -","- C52 H55 Cl4 N12 -","4","1","","Song, Xiao; Tang, Zhishu; Zuo, Zhenyu; Duan, Jinao","The crystal structure of 2-(tert-butyl)-4-chloro-6-phenyl-1,3,5-triazine, C13H14Cl1N3","Zeitschrift für Kristallographie - New Crystal Structures","2018","233","5","779","781","10.1515/ncrs-2017-0386","","","1.54178","CuKα","","0.04","0.0362","","","0.0928","0.0969","","","","","","1.071","","","","has coordinates,has disorder","279623","2022-11-29","08:55:14",""
"9000049","16.54","","8.82","","4.46","","90","","90","","90","","650.637","","","","","","","","","","","","","3","P m a 2","P 2 -2a","28","","","Krennerite","- Ag0.2 Au0.8 Te2 -","- Ag0.2 Au0.8 Te2 -","- Ag1.6 Au6.4 Te16 -","8","2","","Tunell, G.; Murata, K. J.","The atomic arrangement and chemical composition of krennerite","American Mineralogist","1950","35","","959","984","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9005058","39.576","","6.9308","","7.1526","","90","","90","","90","","1961.91","","","","","","","","","","","","","6","P m a 2","P 2 -2a","28","","","Lovdarite","- Be4 H18 K2 Na6 O45 Si14 -","- Be4 H18 K2 Na6 O45 Si14 -","- Be8 H36 K4 Na12 O90 Si28 -","2","0.5","","Merlino, S.","Lovdarite, K4Na12(Be8Si28O72).18H2O, a zeolite-like mineral: structural features and OD character","European Journal of Mineralogy","1990","2","","809","817","10.1127/ejm/2/6/0809","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9009618","16.58","","8.849","","4.464","","90","","90","","90","","654.942","","","","","","","","","","","","Sacaramb, Romania","3","P m a 2","P 2 -2a","28","","","Krennerite","- Ag0.375 Au1.625 Te4 -","- Ag0.375 Au1.625 Te4 -","- Ag1.5 Au6.5 Te16 -","4","1","","Pertlik, F.","Crystal chemistry of natural tellurides II: Redetermination of the crystal structure of krennerite, (Au1-xAgx)Te2 with x ~ 0.2","Tschermaks Mineralogische und Petrographische Mitteilungen","1984","33","","253","262","10.1007/BF01082672","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9016172","16.59","","8.867","","4.4886","","90","","90","","90","","660.289","","","","","","","","","","","","Cripple Creek, Colorado, USA","3","P m a 2","P 2 -2a","28","","","Krennerite","- Ag0.507 Au1.49 Te4 -","- Ag2.026 Au5.962 Te16 -","- Ag2.026 Au5.962 Te16 -","","","","Dye, M. D.; Smyth, J. R.","The crystal structure and genesis of krennerite, Au3AgTe8","The Canadian Mineralogist","2012","50","","119","127","10.3749/canmin.50.1.119","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""