# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T21:06:15+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 'Journal of Physics and Chemistry of Solids') AND volume = 50 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
"1523214","6.079","0.005","6.079","0.005","6.079","0.005","90","","90","","90","","224.645","","","","","","","","","","","","","2","F -4 3 m","F -4 2 3","216","","Zn Te","","- Te Zn -","- Te Zn -","- Te4 Zn4 -","4","0.0416667","","Baudour, J. L.; Granger, M. M.; Toupet, L.; Granger, R.; Triboulet, R.","Composition dependence of thermal variations in Hg~1-x~Zn~x~Te solid solutions determined by X-ray diffraction","Journal of Physics and Chemistry of Solids","1989","50","3","309","318","10.1016/0022-3697(89)90493-9","","","","","","","","","","","","","","","","","","","","","has coordinates","209055","2020-10-21","18:00:00",""
"1539693","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Pr3 Sb5 O12","","- O12 Pr3 Sb5 -","- O12 Pr3 Sb5 -","- O48 Pr12 Sb20 -","4","0.0833333","","Fernandez, F.; Saez-Puche, R.; Rasines, I.; Marcano, C.M.; Cascales, C.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168683","2020-10-21","18:00:00",""
"1539698","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Nd3 Sb5 O12","","- Nd3 O12 Sb5 -","- Nd3 O12 Sb5 -","- Nd12 O48 Sb20 -","4","0.0833333","","Fernandez, F.; Rasines, I.; Saez-Puche, R.; Cascales, C.; Marcano, C.M.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168688","2020-10-21","18:00:00",""
"1539702","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Sm3 Sb5 O12","","- O12 Sb5 Sm3 -","- O12 Sb5 Sm3 -","- O48 Sb20 Sm12 -","4","0.0833333","","Fernandez, F.; Saez-Puche, R.; Cascales, C.; Marcano, C.M.; Rasines, I.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168693","2020-10-21","18:00:00",""
"1539706","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Eu3 Sb5 O12","","- Eu3 O12 Sb5 -","- Eu3 O12 Sb5 -","- Eu12 O48 Sb20 -","4","0.0833333","","Fernandez, F.; Saez-Puche, R.; Cascales, C.; Marcano, C.M.; Rasines, I.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168698","2020-10-21","18:00:00",""
"1539708","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Gd3 Sb5 O12","","- Gd3 O12 Sb5 -","- Gd3 O12 Sb5 -","- Gd12 O48 Sb20 -","4","0.0833333","","Fernandez, F.; Saez-Puche, R.; Cascales, C.; Marcano, C.M.; Rasines, I.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168702","2020-10-21","18:00:00",""
"1539712","11.0356","","11.0356","","11.0356","","90","","90","","90","","1343.96","","","","","","","","","","","","","3","I -4 3 m","I -4 2 3","217","","Yb3 Sb5 O12","","- O12 Sb5 Yb3 -","- O12 Sb5 Yb3 -","- O48 Sb20 Yb12 -","4","0.0833333","","Fernandez, F.; Saez-Puche, R.; Cascales, C.; Marcano, C.M.; Rasines, I.","X-Ray diffraction data and magnetic properties of the oxides R3 Sb5 O12","Journal of Physics and Chemistry of Solids","1989","50","","871","875","","","","","","","","","","","","","","","","","","","","","","has coordinates","168707","2020-10-21","18:00:00",""
"1540820","9.589","","17.154","","14.583","","90","","99.89","","90","","2363.11","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Cs2 (Fe (C N)5 (N O))","","- C5 Cs2 Fe N6 O -","- C5 Cs2 Fe N6 O -","- C40 Cs16 Fe8 N48 O8 -","8","2","","Vergara, M.M.; Varetti, E.L.; Rigotti, G.; Navaza, A.","The crystalline and molecular structure and the vibrational spectra of anhydrous cesium nitroprusside","Journal of Physics and Chemistry of Solids","1989","50","","951","956","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540861","24.726","","24.726","","24.726","","90","","90","","90","","15116.9","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","K54.7 (Al54.7 Si137.3 O384) (H2 O)50.08","","- Al54.7008 K32.128 O384 Si137.299 -","- Al54.7008 K32.128 O384 Si137.299 -","- Al54.7008 K32.128 O384 Si137.299 -","1","0.00520833","","van Dun, J.J.; Dhaeze, K.; Vaughan, D.E.W.; Mortier, W.J.","The inluence of isomorphous substitution on the cation distribution in faujasite-type zeolites; The structures of dehydrated Na-LZ210 and hydrated KGaY","Journal of Physics and Chemistry of Solids","1989","50","","469","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","172023","2020-10-21","18:00:00",""
"1540862","24.77879","","24.77879","","24.77879","","90","","90","","90","","15213.9","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","K55.8 (Al55.8 Si136.2 O384) (H2 O)278","","- Al55.7952 K25.856 O384 Si136.205 -","- Al55.7952 K25.856 O384 Si136.205 -","- Al55.7952 K25.856 O384 Si136.205 -","1","0.00520833","","van Dun, J.J.; Dhaeze, K.; Vaughan, D.E.W.; Mortier, W.J.","The inluence of isomorphous substitution on the cation distribution in faujasite-type zeolites; The structures of dehydrated Na-LZ210 and hydrated KGaY","Journal of Physics and Chemistry of Solids","1989","50","","469","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","172024","2020-10-21","18:00:00",""
"9011991","7.38","","10.73","","11.14","","90","","90","","90","","882.148","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Fe2 S4 Tl3 -","- Fe2 S4 Tl3 -","- Fe8 S16 Tl12 -","4","0.5","","Welz, D.; Deppe, P.; Schaefer, W.; Sabrowsky, H.; Rosenberg, M.","Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium I. Chain structures","Journal of Physics and Chemistry of Solids","1989","50","","297","308","10.1016/0022-3697(89)90492-7","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011992","11.68","","5.32","","10.53","","90","","144.6","","90","","379.029","","","","","","","","","","","","Synthetic","3","C 1 2/m 1","-C 2y","12","","","Raguinite","- Fe S2 Tl -","- Fe S2 Tl -","- Fe4 S8 Tl4 -","4","0.5","","Welz, D.; Deppe, P.; Schaefer, W.; Sabrowsky, H.; Rosenberg, M.","Magnetism of iron-sulfur tetrahedral frameworks in compounds with thallium I. Chain structures","Journal of Physics and Chemistry of Solids","1989","50","","297","308","10.1016/0022-3697(89)90492-7","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""