# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-27T22:51:11+02:00
# 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 fuer Kristallographie (149,1979-)') AND volume = 193 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
"6000519","5.8486","","5.8486","","5.8486","","90","","90","","90","","200.06","","","","160","","","","","","","","","2","Fm3m","","","","","","- D2 S -","","","","","","Cockcroft, J. K.; Fitch, A. N.","The solid-phases of deuterium sulfide by powder neutron-diffraction","Zeitschrift für Kristallographie","1990","193","1-4","1","19","10.1524/zkri.1990.193.14.1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000520","5.7647","","5.7647","","5.7647","","90","","90","","90","","191.57","","","","120","","","","","","","","","2","Pa3","","","","","","- D2 S -","","","","","","Cockcroft, J. K.; Fitch, A. N.","The solid-phases of deuterium sulfide by powder neutron-diffraction","Zeitschrift für Kristallographie","1990","193","1-4","1","19","10.1524/zkri.1990.193.14.1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000521","4.076","","13.3801","","6.7215","","90","","90","","90","","366.57","","","","1.5","","","","","","","","","2","P b c m","","","","","","- D2 S -","","","","","","Cockcroft, J. K.; Fitch, A. N.","The solid-phases of deuterium sulfide by powder neutron-diffraction","Zeitschrift für Kristallographie","1990","193","1-4","1","19","10.1524/zkri.1990.193.14.1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"8103455","9.8344","","9.6736","","9.8592","","90","","109.77","","90","","882.661","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cs3 (B P2)","","- B Cs3 P2 -","- B Cs3 P2 -","- B4 Cs12 P8 -","4","0.5","","Peters, K.; Popp, T.; Somer, M.; von Schnering, H.G.","Crystal structure of cesium diphosphidoborate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","297","298","10.1524/zkri.1990.193.3-4.297","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103467","6.9947","","9.2789","","9.159","","90","","111.03","","90","","554.853","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Na3 (B P2)","","- B Na3 P2 -","- B Na3 P2 -","- B4 Na12 P8 -","4","1","","Somer, M.; Peters, K.; Popp, T.; von Schnering, H.G.","Crystal structure of sodium diphosphidoborate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","281","282","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8104021","4.757","","4.757","","32.04999","","90","","90","","120","","628.094","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Li8 Pb3 -","- Li8 Pb3 -","- Li24 Pb9 -","3","0.0833333","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104022","3.963","","3.963","","19.98","","90","","90","","120","","271.753","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Pt Te -","- Pt Te -","- Pt6 Te6 -","6","0.166667","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104023","4.003","","4.003","","50.89","","90","","90","","120","","706.211","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Pt2 Te3 -","- Pt2 Te3 -","- Pt12 Te18 -","6","0.166667","","Cenzual, K.; Parthe, E.; Gelato, M.N.; Penzo, M.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104024","3.988","","3.988","","35.39","","90","","90","","120","","487.44","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Pt3 Te4 -","- Pt3 Te4 -","- Pt9 Te12 -","3","0.0833333","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104025","14.42","","14.42","","17.64999","","90","","90","","120","","3178.38","","","","","","","","","","","","","3","R 3 2 :H","R 3 2""","155","","","","- Ca Ga6 Te10 -","- Ca1.00005 Ga6 Te10 -","- Ca6.0003 Ga36 Te60 -","6","0.333333","","Cenzual, K.; Penzo, M.; Gelato, M.N.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104026","14.081","","14.081","","21.79999","","90","","90","","120","","3743.29","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- La3.258 Mn1.1 S6 -","- La3.282 Mn1.1 S6 -","- La49.23 Mn16.5 S90 -","15","0.833333","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104027","13.983","","13.983","","21.68999","","90","","90","","120","","3672.74","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","La3.22 Fe1.1 S6","","- Fe1.1 La3.22 S6 -","- Fe1.1 La3.216 S6 -","- Fe16.5 La48.24 S90 -","15","0.833333","","Cenzual, K.; Gelato, M.N.; Parthe, E.; Penzo, M.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","163484","2020-10-21","18:00:00",""
"8104028","5.048","","5.048","","43.64","","90","","90","","120","","963.062","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li Fe6 Ge5","","- Fe6 Ge5 Li -","- Fe6 Ge5 Li -","- Fe36 Ge30 Li6 -","6","0.166667","","Cenzual, K.; Parthe, E.; Gelato, M.N.; Penzo, M.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104029","5.045","","5.045","","19.66","","90","","90","","120","","433.348","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li Fe6 Ge4","","- Fe6 Ge4 Li -","- Fe6 Ge4 Li -","- Fe18 Ge12 Li3 -","3","0.0833333","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104371","8.871","","11.879","","15.28","","72.474","","73.349","","71.623","","1424.1","","","","","","","","","","","","","3","P -1","-P 1","2","","K12 (Al P2)2 (Al2 P4)","","- Al4 K12 P8 -","- Al4 K12 P8 -","- Al8 K24 P16 -","2","1","","Somer, M.; Peters, K.; Walz, L.; von Schnering, H.G.","Crystal structure of potassium di-mue-phosphido-bis (phosphidoaluminate) catena-diphosphidoaluminate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","301","302","","","","","","","","","","","","","","","","","","","","","","has coordinates","173209","2020-10-21","18:00:00",""
"8104374","9.0615","","12.1638","","15.5695","","72.4","","73.05","","71.63","","1515.45","","","","","","","","","","","","","3","P -1","-P 1","2","","K12 (Al As)2 As2 (Al2 As4)","","- Al4 As8 K12 -","- Al4 As8 K12 -","- Al8 As16 K24 -","2","1","","von Schnering, H.G.; Somer, M.; Walz, L.; Blase, W.; Peters, K.; Cordier, G.","Crystal structure of potassium catena-di-mue-arsenidoaluminate di-mue-arsenido-bis(arsenidoaluminate)","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","299","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","173254","2020-10-21","18:00:00",""
"8104453","10.8446","","6.5069","","12.7074","","90","","100.95","","90","","880.368","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Cs6 (Al Sb3)","","- Al Cs6 Sb3 -","- Al Cs6 Sb3 -","- Al2 Cs12 Sb6 -","2","0.5","","von Schnering, H.G.; Peters, K.; Somer, M.; Blase, W.; Cordier, G.","Crystal structure of cesium triantimonidoaluminate, Cs6 Al Sb3","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","283","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104459","11.173","","8.661","","18.939","","90","","99.64","","90","","1806.84","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Cs6 (P2 (Ga P)2)","","- Cs6 Ga2 P4 -","- Cs6 Ga2 P4 -","- Cs24 Ga8 P16 -","4","1","","Somer, M.; Peters, K.; Thiery, D.; Hartweg, M.; Walz, L.; von Schnering, H.G.","Crystal structure of cesium di-mue-phosphido-bis(phosphidogallate)","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","287","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","174060","2020-10-21","18:00:00",""
"8104460","11.233","","8.641","","18.986","","90","","100.056","","90","","1814.55","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Cs6 (P2 (Al P)2)","","- Al2 Cs6 P4 -","- Al2 Cs6 P4 -","- Al8 Cs24 P16 -","4","1","","Somer, M.; Thiery, D.; Walz, L.; von Schnering, H.G.","Crystal structure of cesium di-mue-phosphido-bis(phosphidoaluminate)","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","303","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","174061","2020-10-21","18:00:00",""
"8104487","6.7331","","14.8089","","6.5736","","90","","90","","90","","655.452","","","","","","","","","","","","","4","I b a m","-I 2 2c","72","","K2 Na (Ga As2)","","- As2 Ga K2 Na -","- As2 Ga K2 Na -","- As8 Ga4 K8 Na4 -","4","0.25","","Somer, M.; Peters, K.; Peters, E.M.; von Schnering, H.G.","Crystal structure of dipotassium sodium catena-diarsenidogallate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","285","286","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104513","6.43","","13.648","","5.644","","90","","90","","90","","495.298","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","K2 (Ni P2)","","- K2 Ni P2 -","- K2 Ni P2 -","- K8 Ni4 P8 -","4","0.25","","Somer, M.; Hartweg, M.; Peters, K.; von Schnering, H.G.","Crystal structure of potassium catena-di-mue-phosphidoniccolate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","291","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104514","6.6065","","13.867","","5.7452","","90","","90","","90","","526.331","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","K2 (Ni As2)","","- As2 K2 Ni -","- As2 K2 Ni -","- As8 K8 Ni4 -","4","0.25","","Somer, M.; Hartweg, M.; Peters, K.; von Schnering, H.G.","Crystal structure of potassium catena-di-mue-arsenidoniccolate","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","293","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9011492","28.583","","8.6","","5.219","","90","","91.03","","90","","1282.69","","","","","","","","","","","","Lovozero, Kola Peninsula, Russia","6","C 1 2/c 1","-C 2yc","15","","","Lintisite","- H4 Li Na3 O16 Si4 Ti2 -","- H4 Li Na3 O16 Si4 Ti2 -","- H16 Li4 Na12 O64 Si16 Ti8 -","4","0.5","","Merlino, S.; Pasero, M.","The crystal structure of lintisite, Na3LiTi2[Si2O6]2O2*2H2O, a new titanosilicate from Lovozero (USSR)","Zeitschrift fur Kristallographie","1990","193","","137","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""