# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-01T03:26:45+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 'Kristallografiya') AND volume = 49 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
"1534163","13.11","","13.11","","3.8625","","90","","90","","120","","574.916","","","","","","","","","","","","","4","P 6/m","-P 6","175","","K6 Ta6.27 O15 F7.4","","- F7.4 K6 O15 Ta6.27 -","- F7.356 K6 O15 Ta6.271 -","- F7.356 K6 O15 Ta6.271 -","1","0.0833333","","Arakcheeva, A.V.; Chapuis, G.; Grinevich, V.V.; Shamrai, V.F.","Structure type of hexagonal tantalum bronzes with variable composition K6 Ta6+z O15 F6 (F,O)y: Ta-bronzes and Ta-compounds","Kristallografiya","2004","49","","75","91","","","","","","","","","","","","","","","","","","","","","","has coordinates","160667","2020-10-21","18:00:00",""
"1534164","13.123","","13.123","","3.8622","","90","","90","","120","","576.012","","","","","","","","","","","","","4","P 6/m","-P 6","175","","K6 Ta7.05 O15 F7.1","","- F7.1 K6 O15 Ta7.05 -","- F7.104 K6 O15 Ta7.047 -","- F7.104 K6 O15 Ta7.047 -","1","0.0833333","","Arakcheeva, A.V.; Chapuis, G.; Grinevich, V.V.; Shamrai, V.F.","Structure type of hexagonal tantalum bronzes with variable composition K6 Ta6+z O15 F6 (F,O)y: Ta-bronzes and Ta-compounds","Kristallografiya","2004","49","","75","91","","","","","","","","","","","","","","","","","","","","","","has coordinates","160668","2020-10-21","18:00:00",""
"1534165","13.132","","13.132","","3.861","","90","","90","","120","","576.623","","","","","","","","","","","","","4","P 6/m","-P 6","175","","K6 Ta6.88 O15 F8.2","","- F8.2 K6 O15 Ta6.88 -","- F8.184 K6 O15 Ta6.876 -","- F8.184 K6 O15 Ta6.876 -","1","0.0833333","","Arakcheeva, A.V.; Chapuis, G.; Grinevich, V.V.; Shamrai, V.F.","Structure type of hexagonal tantalum bronzes with variable composition K6 Ta6+z O15 F6 (F,O)y: Ta-bronzes and Ta-compounds","Kristallografiya","2004","49","","75","91","","","","","","","","","","","","","","","","","","","","","","has coordinates","160669","2020-10-21","18:00:00",""
"1534215","15.941","","11.877","","6.625","","90","","95.09","","90","","1249.37","","","","","","","","","","","","","10","C 1 2/c 1","-C 2yc","15","","(Mn1.14 Fe2.35 Zn0.72 Al0.28 Mg0.19) Ca2 Be4 (P O4)6 (O H)4 (H2 O)6","","- Al0.28 Be4 Ca2 Fe2.35 H16 Mg0.19 Mn1.14 O34 P6 Zn0.72 -","- Al0.28 Be4 Ca2 Fe2.36 H8 Mg0.2 Mn1.12 O34 P6 Zn0.72 -","- Al0.56 Be8 Ca4 Fe4.72 H16 Mg0.4 Mn2.24 O68 P12 Zn1.44 -","2","0.25","","Barinova, A.V.; Rastsvetaeva, R.K.; Chukanov, N.V.; Pietraszko, A.","Refinement of the crystal structure of Zn-containing greifensteinite","Kristallografiya","2004","49","","1037","1041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534249","8.385","","8.385","","20.71","","90","","90","","120","","1261.01","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Ho (B6 O9 (O H)3)","","- B6 H3 Ho O12 -","- B6 Ho O12 -","- B36 Ho6 O72 -","6","0.333333","","Belokoneva, E.L.; Ivanova, A.G.; Stefanovich, S.Yu.; Dimitrova, O.V.; Kurazhkovskaya, V.S.","New Ln (B6 O9 (O H)3) (Ln= Sm- Lu) borates: structure properties, and structural relation to cationic Li4 (B7 O12) Cl conductors (Li-boracites)","Kristallografiya","2004","49","","681","691","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534250","8.41","","8.41","","20.72","","90","","90","","120","","1269.15","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Gd (B6 O9 (O H)3)","","- B6 Gd H3 O12 -","- B6 Gd O12 -","- B36 Gd6 O72 -","6","0.333333","","Belokoneva, E.L.; Stefanovich, S.Yu.; Ivanova, A.G.; Dimitrova, O.V.; Kurazhkovskaya, V.S.","New Ln (B6 O9 (O H)3) (Ln= Sm- Lu) borates: structure properties, and structural relation to cationic Li4 (B7 O12) Cl conductors (Li-boracites)","Kristallografiya","2004","49","","681","691","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534263","8.405","","8.405","","5.0112","","90","","90","","120","","306.583","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","Pb3 Ga2 Ge4 O14","","- Ga2 Ge4 O14 Pb3 -","- Ga2 Ge4 O14 Pb3 -","- Ga2 Ge4 O14 Pb3 -","1","0.166667","","Bezmaternykh, L.N.; Vasil'ev, A.D.; Temerov, V.L.; Gudim, I.A.","The growth and structure of Pb3 Ga2 Ge4 O14 and Ba3 Ga2 Ge4 O14 single crystals","Kristallografiya","2004","49","","325","328","","","","","","","","","","","","","","","","","","","","","","has coordinates","160809","2020-10-21","18:00:00",""
"1534264","8.367","","8.367","","5.4397","","90","","90","","120","","329.796","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","","","- Ba3 Ga2 Ge4 O14 -","- Ba3 Ga2 Ge4 O14 -","- Ba3 Ga2 Ge4 O14 -","1","0.166667","","Bezmaternykh, L.N.; Vasil'ev, A.D.; Gudim, I.A.; Temerov, V.L.","The growth and structure of Pb3 Ga2 Ge4 O14 and Ba3 Ga2 Ge4 O14 single crystals","Kristallografiya","2004","49","","325","328","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535601","7.818","","7.818","","30.174","","90","","90","","90","","1844.27","","","","","","","","","","","","","5","P 41","P 4w","76","","Rb4 Li H3 (Se O4)4","","- H3 Li O16 Rb4 Se4 -","- H3 Li O16 Rb4 Se4 -","- H12 Li4 O64 Rb16 Se16 -","4","1","","Troyanov, S.I.; Ling, C.D.; Snigireva, E.M.","X-ray and neutron diffraction studies of Rb4 Li H3 (X O4)4 (X = S, Se) single crystals","Kristallografiya","2004","49","","1066","1072","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535604","7.6316","","7.6316","","29.5","","90","","90","","90","","1718.12","","","","","","","","","","","","","5","P 41","P 4w","76","","Rb4 Li H3 (S O4)4","","- H3 Li O16 Rb4 S4 -","- H3 Li O16 Rb4 S4 -","- H12 Li4 O64 Rb16 S16 -","4","1","","Troyanov, S.I.; Snigireva, E.M.; Ling, C.D.","X-ray and neutron diffraction studies of Rb4 Li H3 (X O4)4 (X = S, Se) single crystals","Kristallografiya","2004","49","","1066","1072","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536909","9.595","","9.595","","6.067","","90","","90","","120","","483.721","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Nd (H Se O4)3","","- H3 Nd O12 Se3 -","- Nd O12 Se3 -","- Nd2 O24 Se6 -","2","0.166667","","Zakharov, M.A.; Kemnitz, E.; Troyanov, S.I.","Synthesis and crystal structure of the rare earth selenates: Nd(HSeO4)3, Sm(HSeO4)3 and Nd2(SeO4)3*5H2O","Kristallografiya","2004","49","","835","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536913","9.522","","9.522","","6.011","","90","","90","","120","","471.991","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Sm (H Se O4)3","","- H3 O12 Se3 Sm -","- H3 O12 Se3 Sm -","- H6 O24 Se6 Sm2 -","2","0.166667","","Zakharov, M.A.; Troyanov, S.I.; Kemnitz, E.","Synthesis and crystal structure of the rare earth selenates: Nd(HSeO4)3, Sm(HSeO4)3 and Nd2(SeO4)3*5H2O","Kristallografiya","2004","49","","835","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536915","10.629","","13.975","","9.752","","90","","93.13","","90","","1446.4","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Nd2 (Se O4)3 (H2 O)5","","- H10 Nd2 O17 Se3 -","- Nd2 O17 Se3 -","- Nd8 O68 Se12 -","4","1","","Zakharov, M.A.; Kemnitz, E.; Troyanov, S.I.","Synthesis and crystal structure of the rare earth selenates: Nd(HSeO4)3, Sm(HSeO4)3 and Nd2(SeO4)3*5H2O","Kristallografiya","2004","49","","835","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","164809","2020-10-21","18:00:00",""
"1537338","8.6468","","8.6468","","23.9436","","90","","90","","120","","1550.35","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Ba0.5 Zr2 (P O4)3","","- Ba0.5 O12 P3 Zr2 -","- Ba0.5 O12 P3 Zr2 -","- Ba3 O72 P18 Zr12 -","6","0.333333","","Gobechiya, E.R.; Kabalov, Yu.K.; Pet'kov, V.I.; Sukhanov, M.V.","Crystal structures of double cesium zirconium and barium zirconium orthophosphates","Kristallografiya","2004","49","","829","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","165429","2020-10-21","18:00:00",""
"1537339","8.5758","","8.5758","","24.9061","","90","","90","","120","","1586.3","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Cs Zr2 (P O4)3","","- Cs O12 P3 Zr2 -","- Cs O12 P3 Zr2 -","- Cs6 O72 P18 Zr12 -","6","0.166667","","Gobechiya, E.R.; Sukhanov, M.V.; Kabalov, Yu.K.; Pet'kov, V.I.","Crystal structures of double cesium zirconium and barium zirconium orthophosphates","Kristallografiya","2004","49","","829","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537349","10.797","","10.492","","16.121","","90","","90.61","","90","","1826.12","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","K2 (Np O2)2 (Cr O4)3 (H2 O)4","","- Cr3 H8 K2 Np2 O20 -","- Cr3 H6 K2 Np2 O20 -","- Cr12 H24 K8 Np8 O80 -","4","1","","Grigor'ev, M.S.; Fedoseev, A.M.; Budantseva, N.A.; Bessonov, A.A.; Krupa, J.C.","Synthesis and X-ray diffraction study of complex neptunium (VI) potassium chromate K2 ((Np O2)2 (CrO4)3 (H2O)) * 3H2 O","Kristallografiya","2004","49","","676","680","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537521","11.338","","9.981","","15.675","","90","","90","","90","","1773.85","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","((C H3)2 N H2)2 Cu Cl4 ((C H3)2 N H2) Cl","","- C6 H24 Cl5 Cu N3 -","- C6 H24 Cl5 Cu N3 -","- C24 H96 Cl20 Cu4 N12 -","4","1","","Kirpichnikova, L.F.; Pietraszko, A.; Bednarski, W.; Sheleg, A.U.; Waplak, S.","Crystal structure and phase transitions in the new crystals of ((C H3)2 N H2)2 Cu Cl4 ((C H3)2 N H2) Cl","Kristallografiya","2004","49","","92","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538332","5.202","","8.312","","14.394","","90","","90.02","","90","","622.382","","","","","","","","","","","","","5","A 1 2 1","A 2y","5","","La3 Sb Zn3 Ge2 O14","","- Ge2 La3 O14 Sb Zn3 -","- Ge2 La3 O14 Sb Zn3 -","- Ge4 La6 O28 Sb2 Zn6 -","2","0.5","","Maksimov, B.A.; Kasantsev, S.S.; Molchanov, V.N.; Verin, I.A.; Mill, B.V.","Crystal structure and microtwinning of monoclinic La3SbZn3Ge2O14 crystals of the langasite family","Kristallografiya","2004","49","","662","667","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538508","8.226","","8.226","","5.1374","","90","","90","","120","","301.059","","","","","","","","","","","","","5","P 3 2 1","P 3 2""","150","","La3 (Zr0.5 Ga0.5) Ga3 (Ga1.5 Si0.5) O14","","- Ga5 La3 O14 Si0.5 Zr0.5 -","- Ga5 La3.036 O14 Si0.5 Zr0.5 -","- Ga5 La3.036 O14 Si0.5 Zr0.5 -","1","0.166667","","Pugacheva, A.A.; Maksimov, B.A.; Simonov, V.I.; Mill', B.V.; Pisarevskii, Yu.V.; Kondakov, D.F.; Chernaya, T.S.; Verin, I.A.; Molchanov, V.N.","Growth and structure of La3 Zr0.5 Ga5 Si0.5 O14 crystals","Kristallografiya","2004","49","","58","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","167098","2020-10-21","18:00:00",""
"1538533","12.757","","12.757","","32.211","","90","","90","","120","","4539.75","","","","","","","","","","","","","8","P 3","P 3","143","","Na31.1 Ca15.94 K0.96 (Si36 Al36 O144) (S O4)9.3 (S O3)0.7 Cl8","","- Al36 Ca15.94 Cl8 K0.96 Na31.1 O183.3 S10 Si36 -","- Al36 Ca15.93 Cl8 K0.96 Na31.11 O183.3 S10 Si36 -","- Al36 Ca15.93 Cl8 K0.96 Na31.11 O183.3 S10 Si36 -","1","0.333333","","Rozenberg, K.A.; Sapozhnikov, A.N.; Kashaev, A.A.; Rastsvetaeva, R.K.; Bolotina, N.B.","Crystal structure and of a new representative of the cancrinite group with a 12-layer staking sequence of tetrahedral rings","Kristallografiya","2004","49","","714","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","167152","2020-10-21","18:00:00",""
"1538543","5.433","","5.433","","5.433","","90","","90","","90","","160.369","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Cd0.90 Tb0.10 F2.10","","- Cd0.9 F2.1 Tb0.1 -","- Cd0.9 F2.12 Tb0.1 -","- Cd3.6 F8.48 Tb0.4 -","4","0.0208333","","Ryzhova, E.A.; Molchanov, V.N.; Simonov, V.I.; Artyukhov, A.A.; Sobolev, B.P.","Growth and defect crystal structure of Cd F2 and non-stoichiometric Cd1-x Rx F2+x phases (R= rare earth elements and In). 2. Methods of structure refinement of Cd0.9 R0.1 F2.1 phases an exemple of Cd0.9 Tb0.1 F2.1 structure of nanodimensional clusters in Cd0.9 Tb0.1 F2.1 crystals","Kristallografiya","2004","49","","668","675","","","","","","","","","","","","","","","","","","","","","","has coordinates","167172","2020-10-21","18:00:00",""
"1539086","10.184","","10.184","","5.306","","90","","90","","90","","550.306","","","","","","","","","","","","","1","P -4 21 m","P -4 2ab","113","","","","- Ta30 -","- Ta30 -","- Ta30 -","1","0.125","","Shamrai, V.F.; Warhulska, A.V.; Arakcheeva, A.V.; Grinevich, V.V.","Magnetic properties and crystal structure of Ta beta","Kristallografiya","2004","49","","1025","1030","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539382","10.3528","","10.3528","","10.3528","","90","","90","","90","","1109.62","","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Pr K2 Zr (P O4)3","","- K2 O12 P3 Pr Zr -","- K2 O12 P3 Pr Zr -","- K8 O48 P12 Pr4 Zr4 -","4","0.333333","","Trubach, I.G.; Orlova, A.I.; Beskrovnyi, A.I.; Orlova, V.A.; Kurazhkovskaya, V.S.","Synthesis and investigation of new phosphates K2 Ln Zr (P O4)3 (Ln= Ce- Yb, Y) with langbeinite structure","Kristallografiya","2004","49","","692","696","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539386","10.1199","","10.1199","","10.1199","","90","","90","","90","","1036.4","","","","","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","Rb2 Fe Zr (P O4)3","","- Fe O12 P3 Rb2 Zr -","- Fe O12 P3 Rb2 Zr -","- Fe4 O48 P12 Rb8 Zr4 -","4","0.333333","","Trubach, I.G.; Beskrovnyi, A.I.; Orlova, A.I.; Orlova, V.A.; Kurazhkovskaya, V.S.","Synthesis and structural study of the Rb2 Fe Zr (P O4)3 phosphate with langbeinite structure","Kristallografiya","2004","49","","991","994","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539929","12.5985","","15.7448","","3.61256","","90","","90","","90","","716.591","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","Zr2 Se","","- Se Zr2 -","- Se Zr2 -","- Se12 Zr24 -","12","1.5","","Weirich, T.E.","The crystal structure of Zr2 Se reinvestigated by electron crystallography and X-ray powder diffraction","Kristallografiya","2004","49","","445","455","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539972","16.85","","9.729","","9.298","","90","","90","","90","","1524.26","","","","","","","","","","","","","9","C c c m","-C 2 2c","66","","(Mg1.86 Fe0.14) (Na0.28 Ca0.19) (Al3.39 Be0.61 Si5 O18) (H2 O)0.92","","- Al3.39 Be0.61 Ca0.19 Fe0.14 H1.84 Mg1.86 Na0.28 O18.92 Si5 -","- Al3.388 Be0.612 Ca0.192 Fe0.14 H1.856 Mg1.86 Na0.276 O18.928 Si5 -","- Al13.552 Be2.448 Ca0.768 Fe0.56 H7.424 Mg7.44 Na1.104 O75.712 Si20 -","4","0.25","","Yakubovich, O.V.; Massa, W.; Gavrilenko, P.G.; Pekov, I.V.; Chukanov, N.V.","Crystal structure of the Na-, Ca-, Be-cordierite and crystallochemical regularities in the cordierite-sekaninaite series","Kristallografiya","2004","49","","1049","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540006","22.301","","10.514","","9.669","","90","","90","","90","","2267.12","","","","","","","","","","","","","9","A m a 2","A 2 -2a","40","","Na Mn Ba2 Ce2 (Ti O)2 (Si4 O12)2 F0.7 (O H)0.3 (H2 O)0.7","","- Ba2 Ce2 F0.7 H1.7 Mn Na O27 Si8 Ti2 -","- Ba2 Ce2 F0.7 Mn Na O27 Si8 Ti2 -","- Ba8 Ce8 F2.8 Mn4 Na4 O108 Si32 Ti8 -","4","0.5","","Zubkova, N.V.; Pekov, I.V.; Pushcharovskii, D.Yu.; Giester, G.; Tillmanns, E.; Krotova, O.D.","Crystal structure of byelorussite-(Ce) Na Mn Ba2 Ce2 (Ti O)2 (Si4 O12)2 (F, O H) H2 O","Kristallografiya","2004","49","","1061","1065","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""