# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T06:32:10+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 = 198 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
"8103856","5.2985","","7.911","","6.3473","","90","","90","","90","","266.056","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Ti P O4","","- O4 P Ti -","- O4 P Ti -","- O16 P4 Ti4 -","4","0.25","","Glaum, R.; Gruehn, R.","Beitraege zum thermischen Verhalten wasserfreier Phosphate: VI. Einkristallstrukturverfeinerung der Metall(III)-orthophosphate TiPO4 und VPO4","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","41","47","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103857","5.2316","","7.7738","","6.2847","","90","","90","","90","","255.595","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","V P O4","","- O4 P V -","- O4 P V -","- O16 P4 V4 -","4","0.25","","Glaum, R.; Gruehn, R.","Beitraege zum thermischen Verhalten wasserfreier Phosphate: VI. Einkristallstrukturverfeinerung der Metall(III)-orthophosphate TiPO4 und VPO4","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","41","47","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103877","5.8475","","25.474","","2.9824","","90","","90","","90","","444.256","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","Mg13.7 Ga4.6 Ge1.7 O24","","- Ga4.6 Ge1.7 Mg13.7 O24 -","- Ga4.426 Ge1.7 Mg13.874 O24 -","- Ga4.426 Ge1.7 Mg13.874 O24 -","1","0.0625","","Barbier, J.; Frampton, C.","The crystal structure of (Mg,Ga)8(Ga,Ge)2O12","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","79","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","161836","2020-10-21","18:00:00",""
"8103948","6.449","","6.88","","18.989","","90","","90.87","","90","","842.428","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Na (Ta Cl6)","","- Cl6 Na Ta -","- Cl6 Na Ta -","- Cl24 Na4 Ta4 -","4","1","","Henke, H.","Zur kristallchemischen Einordnung von Na Sb Cl6, Na Nb Cl6 und Na Ta Cl6","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","1","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103949","6.393","","6.393","","10.717","","90","","90","","90","","438.009","","","","","","","","","","","","","3","P 42/m","-P 4c","84","","Na Sb Cl6","","- Cl6 Na Sb -","- Cl6 Na Sb -","- Cl12 Na2 Sb2 -","2","0.25","","Henke, H.","Zur kristallchemischen Einordnung von NaSbCl6, NaNbCl6 und NaTaCl6","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","1","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103950","6.398","","6.85","","19.012","","90","","90.72","","90","","833.16","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Na (Nb Cl6)","","- Cl6 Na Nb -","- Cl6 Na Nb -","- Cl24 Na4 Nb4 -","4","1","","Henke, H.","Zur kristallchemischen Einordnung von Na Sb Cl6, Na Nb Cl6 und Na Ta Cl6","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","1","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103960","15.418","","15.418","","15.418","","90","","90","","90","","3665.09","","","","","","","","","","","","","3","I 2 3","I 2 2 3","197","","K3 H Ge7 O16 (H2 O)4","","- Ge7 K2.235 O19.25 -","- Ge7 K2.235 O19.25 -","- Ge56 K17.88 O154 -","8","0.333333","","Bialek, R.; Gramlich, V.","The superstructure of K3HGe7O16 * 4H2O","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","67","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","162533","2020-10-21","18:00:00",""
"8103961","7.709","","7.709","","7.709","","90","","90","","90","","458.136","","","","","","","","","","","","","4","P -4 3 m","P -4 2 3","215","","K3 H (Ge7 O16) (H2 O)4","","- Ge7 H9 K3 O20 -","- Ge7 K3 O20 -","- Ge7 K3 O20 -","1","0.0416667","","Bialek, R.; Gramlich, V.","The superstructure of K3 H Ge7 O16 * 4(H2 O)","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","67","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104067","6.05","","11.449","","8.305","","90","","90","","90","","575.258","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","Mg2 Co (V O4)2","","- Co Mg2 O8 V2 -","- Co1.04 Mg1.96 O8 V2 -","- Co4.16 Mg7.84 O32 V8 -","4","","","Wang, P.-L.; Werner, P.E.; Nord, A.G.","Cation distribution studies of Mg, Co and Co, Ni orthovanadate solid solutions","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","271","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104068","6.045","","11.475","","8.306","","90","","90","","90","","576.157","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","(Mg1.12 Co1.88) (V O4)2","","- Co1.88 Mg1.12 O8 V2 -","- Co1.88 Mg1.12 O8 V2 -","- Co7.52 Mg4.48 O32 V8 -","4","","","Wang, P.-L.; Werner, P.E.; Nord, A.G.","Cation distribution studies of Mg, Co and Co, Ni orthovanadate solid solutions","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","271","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","163874","2020-10-21","18:00:00",""
"8104069","5.987","","11.437","","8.272","","90","","90","","90","","566.411","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","(Co1.5 Ni1.5) (V O4)2","","- Co1.5 Ni1.5 O8 V2 -","- Co1.54 Ni1.46 O8 V2 -","- Co6.16 Ni5.84 O32 V8 -","4","","","Wang, P.-L.; Werner, P.E.; Nord, A.G.","Cation distribution studies of Mg, Co and Co, Ni orthovanadate solid solutions","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","271","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","163878","2020-10-21","18:00:00",""
"8104117","9.7975","","9.7975","","3.4296","","90","","90","","90","","329.211","","","","","","","","","","","","","2","I 4/m","-I 4","87","","Ta5 As4","","- As4 Ta5 -","- As4 Ta5 -","- As8 Ta10 -","2","0.125","","Dronskowski, R.; Simon, A.; Plambeck-Fischer, P.","Verfeinerung der Kristallstrukturen von Ta5As4 und monoklinem Nb4.7Te4","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","101","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","164318","2020-10-21","18:00:00",""
"8104118","14.443","","3.696","","10.132","","90","","134.47","","90","","385.967","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Nb4.7 Te4 -","- Nb4.692 Te4 -","- Nb9.384 Te8 -","2","0.25","","Dronskowski, R.; Plambeck-Fischer, P.; Simon, A.","Verfeinerung der Kristallstrukturen von Ta5 As4 und monoklinem Nb4.7 Te4","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","101","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104404","14.92","","14.92","","14.426","","90","","90","","120","","2781.08","","","","","","","","","","","","","3","P -3","-P 3","147","","Rb4 Sn Sb6","","- Rb4 Sb6 Sn -","- Rb4 Sb6 Sn -","- Rb24 Sb36 Sn6 -","6","1","","Asbrand, M.; Eisenmann, B.","Crystal structure of tetrarubidium monostannidohexaantimonide","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","309","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104451","4.278","","4.278","","11.015","","90","","90","","90","","201.589","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ca Al2 Ga2","","- Al2 Ca Ga2 -","- Al2 Ca Ga2 -","- Al4 Ca2 Ga4 -","2","0.0625","","Pani, M.; Fornasini, M.L.","Crystal structure of calcium dialuminium digallide","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","295","296","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104482","11.944","","11.37","","6.459","","90","","90","","90","","877.153","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","W (C O)6","","- C6 O6 W -","- C6 O6 W -","- C24 O24 W4 -","4","0.5","","Heinemann, F.; Schmidt, H.; Thiery, D.; Peters, K.","Crystal structure of tungsten hexacarbonyl","Zeitschrift fuer Kristallographie (149,1979-)","1992","198","","123","124","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9011493","4.921","","4.921","","5.4163","","90","","90","","120","","113.59","","","","","","","","0","","","","","2","P 31 2 1","","","","","Quartz","- O2 Si -","- O2 Si -","- O6 Si3 -","3","0.5","","Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F.","Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = room pressure","Zeitschrift fur Kristallographie","1992","198","","177","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011494","4.775","","4.775","","5.3046","","90","","90","","120","","104.744","","","","","","","","4000000","","","","","2","P 31 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F.","Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 4.0GPa = 40 kbar","Zeitschrift fur Kristallographie","1992","198","","177","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:29",""
"9011495","4.6764","","4.6764","","5.2475","","90","","90","","120","","99.382","","","","","","","","7200000","","","","","2","P 31 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F.","Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 7.2GPa = 72 kbar","Zeitschrift fur Kristallographie","1992","198","","177","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:29",""
"9011496","4.604","","4.604","","5.207","","90","","90","","120","","95.585","","","","","","","","10200000","","","","","2","P 31 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Glinnemann, J.; King, H. E.; Schulz, H.; Hahn, T.; La Placa, S. J.; Dacol, F.","Crystal structures of the low-temperature quartz-type phases of SiO2 and GeO2 at elevated pressure P = 10.2GPa = 102 kbar","Zeitschrift fur Kristallographie","1992","198","","177","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:29",""