# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-07T09:21:34+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 'Zeitschrift fur Kristallographie') AND volume = 127 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
"9008143","9.621","","17.363","","6.994","","90","","90","","90","","1168.34","","","","","","","","","","","","Montgomery County, Arkansas, USA","4","P c m n","-P 2n 2ac","62","","","Wavellite","- Al3 H15 O16 P2 -","- Al3 H13 O16 P2 -","- Al12 H52 O64 P8 -","4","0.5","","Araki, T.; Zoltai, T.","The crystal structure of wavellite","Zeitschrift fur Kristallographie","1968","127","","21","33","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:21",""
"9008144","5.5962","","5.5962","","22.526","","90","","90","","120","","610.944","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","Diaoyudaoite","- Al11 Na O17 -","- Al11 Na O17 -","- Al22 Na2 O34 -","2","0.0833333","","Felsche, J.","The alkali problem in the crystal structure of beta alumina","Zeitschrift fur Kristallographie","1968","127","","94","100","10.1524/zkri.1968.127.1-4.94","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008145","5.9648","","5.9648","","5.9648","","90.73","","90.73","","90.73","","212.169","","","","","","","","","","","","","2","R -3 :R","-P 3*","148","","","","- Rh3 Se8 -","- Rh3 Se8 -","- Rh3 Se8 -","1","0.166667","","Hohnke, D.; Parthe, E.","The crystal structure of pyrite-related Rh3Se8","Zeitschrift fur Kristallographie","1968","127","","164","172","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008146","7.54","","8.534","","5.766","","90","","90","","90","","371.021","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi Mn2 O5 -","- Bi Mn2 O5 -","- Bi4 Mn8 O20 -","4","0.5","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008147","7.712","","8.112","","5.708","","90","","90","","90","","357.091","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008148","7.905","","8.428","","6.005","","90","","90","","90","","400.073","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi2 Fe4 O9 -","- Bi2 Fe4 O9 -","- Bi4 Fe8 O18 -","2","0.25","","Niizeki, N.; Wachi, M.","The crystal structures of Bi2Mn4O10, Bi2Al4O9 and Bi2Fe4O9","Zeitschrift fur Kristallographie","1968","127","","173","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008149","13.53","","13.53","","13.53","","90","","90","","90","","2476.81","","","","908.15","","","","","","","","Vesuvius, Italy","5","I a -3 d","-I 4bd 2c 3","230","","","Leucite","- Al K0.85 Na0.15 O6 Si2 -","- Al0.99999 K0.85 Na0.15 O6 Si2.00001 -","- Al15.9998 K13.6 Na2.4 O96 Si32.0002 -","16","0.166667","","Peacor, D. R.","A high temperature single crystal diffractometer study of leucite, (K,Na)AlSi2O6 Sample: T = 635 C Locality: Vesuvius, Italy Note: cell parameters were not reported in the paper. A value was chosen that reproduced the reported bond lengths and thermal ellipsoid axes.","Zeitschrift fur Kristallographie","1968","127","","213","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008150","8.976","","11.678","","6.698","","95.65","","90.36","","97.2","","693.052","","","","","","","","","","","","Quetena, Chile","4","P -1","-P 1","2","","","Amarantite","- Fe4 H28 O32 S4 -","- Fe4 H28 O32 S4 -","- Fe4 H28 O32 S4 -","1","0.5","","Susse, P.","The crystal structure of amarantite, Fe2(SO4)2O*7H2O","Zeitschrift fur Kristallographie","1968","127","","261","275","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:21:13",""
"9008151","15.426","","7.32","","7.066","","90","","95.404","","90","","794.335","","","","","","","","","","","","Crestmore, California, USA","3","P 1 21/a 1","-P 2yab","14","","","Wollastonite-2M","- Ca O3 Si -","- Ca O3 Si -","- Ca12 O36 Si12 -","12","3","","Trojer, F. J.","The crystal structure of parawollastonite","Zeitschrift fur Kristallographie","1968","127","","291","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008152","5.217","","5.217","","5.464","","90","","90","","120","","128.79","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","Spodumene-III","- Al0.333 Li0.333 O2 Si0.667 -","- Al0.3333 Li0.3333 O2 Si0.6667 -","- Al0.9999 Li0.9999 O6 Si2.0001 -","3","0.25","","Li, C. T.","The crystal structure of LiAlSi2O6 III (high-quartz solid solution)","Zeitschrift fur Kristallographie","1968","127","","327","348","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008153","9.215","","8.524","","7.98","","55.983","","62.5","","69.4","","457.105","","","","","","","","","","","","Lengenbach quarry, Binnatal, Switzerland","5","P -1","-P 1","2","","","Wallisite","- As2 Cu Pb S5 Tl -","- As2 Cu Pb S5 Tl -","- As4 Cu2 Pb2 S10 Tl2 -","2","1","","Takeuchi, Y.; Ohmasa, M.","The crystal structure of wallisite, PbTlCuAs2S5, the Cu analogue of hatchite PbTlAgAs2S5","Zeitschrift fur Kristallographie","1968","127","","349","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""