# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T04:41:32+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 'Kristallografiya') AND volume = 51 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
"1511489","9.59","","16.659","","22.919","","90","","90","","90","","3661.53","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Ba5 (B O3)2 (B2 O5)","","- B4 Ba5 O11 -","- B4 Ba5 O11 -","- B48 Ba60 O132 -","12","3","","Maksimov, B.A.; Fedorov, P.P.; Molchanov, V.N.; Kononova, N.G.; Furmanova, N.G.; Kokh, A.E.","Crystal structure of the novel barium borate Ba5 (B O3)2 (B2 O5)","Kristallografiya","2006","51","","248","253","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1528298","11.426","","11.328","","6.5735","","90","","90","","90","","850.833","","","","","","","","","","","","","5","P n n 2","P 2 -2n","34","","Na0.5 Pb2 (B5 O9) (O H)1.5 (H2 O)0.5","","- B5 H2.5 Na0.5 O11 Pb2 -","- B5 H Na0.5 O11 Pb2 -","- B20 H4 Na2 O44 Pb8 -","4","1","","Al'-Ama, A.G.; Dimitrova, O.V.; Belokoneva, E.L.; Stefanovich, S.Yu.; Mochenova, N.N.","A new nonlinear optical borate, Na0.5 Pb2 [B5 O9] (O H)1.5 . 0.5H2 O, from the orthorhombic hilgardite family","Kristallografiya","2006","51","","429","433","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528413","8.2196","","8.2196","","5.1217","","90","","90","","120","","299.672","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","La3 Nb0.5 Ga5.5 O14","","- Ga5.5 La3 Nb0.5 O14 -","- Ga5.5 La3 Nb0.5 O14 -","- Ga5.5 La3 Nb0.5 O14 -","1","0.166667","","Chernaya, T.S.; Molchanov, V.N.; Kazantsev, S.S.; Verin, I.A.; Blomberg, M.K.; Maksimov, B.A.; Simonov, V.I.","Crystal structure of La3 Nb0.5 Ga5.5 O14 at 20 K","Kristallografiya","2006","51","","30","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","150593","2020-10-21","18:00:00",""
"1528596","5.5835","","5.5613","","7.887","","90","","90","","90","","244.903","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(La0.89 Sr0.11) (Ga0.56 Mg0.24 Fe0.20) O2.62","","- Fe0.2 Ga0.56 La0.89 Mg0.24 O2.62 Sr0.11 -","- Fe0.2 Ga0.56 La0.89 Mg0.24 O2.62 Sr0.11 -","- Fe0.8 Ga2.24 La3.56 Mg0.96 O10.48 Sr0.44 -","4","0.5","","Ivanov, S.A.; Aleksandrovskii, V.V.; Kaleva, G.M.; Politova, E.D.; Eriksson, S.","Specific features of the structure and weight loss of aliovalent-substituted oxides based on lanthanum gallate (La, Sr) (Ga, Fe, Mg) O(3-y)","Kristallografiya","2006","51","","241","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1528597","7.8106","","5.585","","5.5097","","90","","90.37","","90","","240.34","","","","","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","(La0.89 Sr0.11) (Ga0.56 Mg0.24 Fe0.20) O2.80","","- Fe0.2 Ga0.56 La0.89 Mg0.24 O2.8 Sr0.11 -","- Fe0.2 Ga0.56 La0.89 Mg0.24 O2.8 Sr0.11 -","- Fe0.8 Ga2.24 La3.56 Mg0.96 O11.2 Sr0.44 -","4","0.5","","Ivanov, S.A.; Kaleva, G.M.; Eriksson, S.; Aleksandrovskii, V.V.; Politova, E.D.","Specific features of the structure and weight loss of aliovalent-substituted oxides based on lanthanum gallate (La, Sr) (Ga, Fe, Mg) O(3-y)","Kristallografiya","2006","51","","241","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1528689","5.09227","","5.09227","","14.04","","90","","90","","120","","315.298","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","(Zn0.333 Mn0.37 Mg0.3) Ti O3","","- Mg0.3 Mn0.37 O3 Ti Zn0.333 -","- Mg0.3 Mn0.37 O3 Ti Zn0.33 -","- Mg1.8 Mn2.22 O18 Ti6 Zn1.98 -","6","0.333333","","Liferovich, R.P.; Mitchell, R.H.","Mn, Mg, and Zn ilmenite group titanates: a reconnaissance Rietveld study","Kristallografiya","2006","51","","417","424","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528690","5.06683","","5.06683","","13.9224","","90","","90","","120","","309.54","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","(Zn0.54 Mg0.46) Ti O3","","- Mg0.46 O3 Ti Zn0.54 -","- Mg0.46 O3 Ti Zn0.54 -","- Mg2.76 O18 Ti6 Zn3.24 -","6","0.333333","","Liferovich, R.P.; Mitchell, R.H.","Mn, Mg, and Zn ilmenite group titanates: a reconnaissance Rietveld study","Kristallografiya","2006","51","","417","424","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528799","8.545","","11.447","","13.313","","90","","90.1","","90","","1302.2","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","((C H3)2 N H2)2 (Co Cl4)","","- C4 H16 Cl4 Co N2 -","- C4 Cl4 Co N2 -","- C16 Cl16 Co4 N8 -","4","1","","Pietraszko, A.; Sheleg, A.U.; Kirpichnikova, L.F.; Yachkovsky, A.Y.","Structural study of [(C H3)2 N H2]2 Co Cl4 single crystals at room temperature","Kristallografiya","2006","51","","41","43","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528809","14.134","","14.134","","30.178","","90","","90","","120","","5220.97","","","","","","","","","","","","","13","R 3 :H","R 3","146","","Na13.56 K0.18 Ca2.4 Mn3.51 Fe1.2 Ce0.57 Zr3 Ti0.06 Nb0.43 Si0.46 O2.07 (O H).49 Cl0.35 (H2 O)1.2","","- Ca2.4 Ce0.57 Cl0.35 Fe1.2 H2.89 K0.18 Mn3.51 Na13.56 Nb0.43 O3.76 Si0.46 Ti0.06 Zr3 -","- Ca2.4 Ce0.57 Cl0.35 Fe1.2 K0.18 Mn3.51 Na13.56 Nb0.43 O3.76 Si0.46 Ti0.06 Zr3 -","- Ca7.2 Ce1.71 Cl1.05 Fe3.6 K0.54 Mn10.53 Na40.68 Nb1.29 O11.28 Si1.38 Ti0.18 Zr9 -","3","0.333333","","Rastsvetaeva, R.K.; Rozenberg, K.A.; Moeckel, S.; Chukanov, N.V.; Pekov, I.V.","Crystal structures of two new low-symmetry calcium-deficient analogs of eudialyte","Kristallografiya","2006","51","","235","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528810","14.192","","14.192","","30.17","","90","","90","","120","","5262.51","","","","","","","","","","","","","16","R 3 :H","R 3","146","","Na15.66 K0.21 Ca3 Sr0.36 Y0.09 Mn1.44 Fe1.44 Ce0.33 Zr3.54 Ti0.21 Nb0.27 Si0.9 O2.34 (O H).90 Cl0.53 F0.66 (H2 O)0.86","","- Ca3 Ce0.33 Cl0.53 F0.66 Fe1.44 H2.62 K0.21 Mn1.44 Na15.66 Nb0.27 O4.1 Si0.9 Sr0.36 Ti0.21 Y0.09 Zr3.54 -","- Ca3 Ce0.33 Cl0.53 F0.66 Fe1.44 K0.21 Mn1.44 Na15.66 Nb0.27 O4.1 Si0.9 Sr0.36 Ti0.21 Y0.09 Zr3.54 -","- Ca9 Ce0.99 Cl1.59 F1.98 Fe4.32 K0.63 Mn4.32 Na46.98 Nb0.81 O12.3 Si2.7 Sr1.08 Ti0.63 Y0.27 Zr10.62 -","3","0.333333","","Rastsvetaeva, R.K.; Rozenberg, K.A.; Moeckel, S.; Chukanov, N.V.; Pekov, I.V.","Crystal structures of two new low-symmetry calcium-deficient analogs of eudialyte","Kristallografiya","2006","51","","235","240","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528881","12.745","","12.745","","5.18","","90","","90","","120","","728.685","","","","","","","","","","","","","7","P 63","P 6c","173","","(Na0.5 Ca0.5)2 Na6 (Al6 Si6 O24) (B O3) (H2 O)2","","- Al6 B Ca H4 Na7 O29 Si6 -","- Al6 B Ca H4.0002 Na7 O28.9998 Si6 -","- Al6 B Ca H4.0002 Na7 O28.9998 Si6 -","1","0.166667","","Shirinova, A.F.; Samedov, H.R.; Khrustalev, V.N.; Chiragov, M.I.","Hydrothermal synthesis and the crystal structure of borate cancrinite (Na, Ca) (Na6 (Al Si O4)6) (B O3) . 2H2 O","Kristallografiya","2006","51","","44","47","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""