# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T07:22:42+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 'Journal of Alloys Compd.') AND volume = 306 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
"1520784","5.3627","","5.3627","","5.3627","","90","","90","","90","","154.223","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","Nb3 (Al0.84 Nb0.16) D2.52","","- Al0.84 D2.52 Nb3.16 -","- Al0.84 D2.519 Nb3.16 -","- Al1.68 D5.038 Nb6.32 -","2","0.0416667","","Andersson, Y.; Rundqvist, S.; Nolang, B.; Larsson, T.","Neutron powder diffraction investigations of Nb3 (Al0.84 Nb0.16) and Nb3 (Al0.84 Nb0.16) (2)H2.52","Journal of Alloys Compd.","2000","306","","193","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520858","7.5609","","12.697","","12.736","","116.05","","90.192","","90.031","","1098.45","","","","","","","","","","","","","3","P -1","-P 1","2","","Nb2 Te4 O13","","- Nb2 O13 Te4 -","- Nb2 O13 Te4 -","- Nb8 O52 Te16 -","4","2","","Blanchandin, S.; Thomas, P.; Champarnaud-Mesjard, J.C.; Frit, B.","Crystal structure of Nb2 Te4 O13","Journal of Alloys Compd.","2000","306","","175","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","140418","2020-10-21","18:00:00",""
"1521025","6.12382","","10.28083","","3.58963","","90","","90","","90","","225.996","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Sr2 Pr O4","","- O4 Pr Sr2 -","- O4 Pr Sr2 -","- O8 Pr2 Sr4 -","2","0.25","","Fiscus, J.E.; zur Loye, H.C.","Synthesis of Sr2 Pr O4: a Pr(4+)-containing oxide in the Sr2 Pb O4 structure type","Journal of Alloys Compd.","2000","306","","141","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521072","5.4448","","5.4448","","8.8915","","90","","90","","120","","228.281","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D0.086","","- Al0.5 Ce D0.086 Mn1.5 -","- Al0.49985 Ce D0.0864 Mn1.49995 -","- Al1.9994 Ce4 D0.3456 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521073","5.8462","","5.8462","","9.6452","","90","","90","","120","","285.489","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D2.997","","- Al0.5 Ce D2.997 Mn1.5 -","- Al0.49985 Ce D2.997 Mn1.49995 -","- Al1.9994 Ce4 D11.988 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521074","5.9376","","5.9376","","9.7278","","90","","90","","120","","297.007","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D3.63","","- Al0.5 Ce D3.63 Mn1.5 -","- Al0.49985 Ce D3.6315 Mn1.49995 -","- Al1.9994 Ce4 D14.526 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521077","6.0067","","6.0067","","9.786","","90","","90","","120","","305.779","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce (Mn1.5 Al0.5) D3.975","","- Al0.5 Ce D3.975 Mn1.5 -","- Al0.49985 Ce D3.975 Mn1.49995 -","- Al1.9994 Ce4 D15.9 Mn5.9998 -","4","0.166667","","Gross, K.J.; Chartouni, D.; Fauth, F.","A new hexagonal Laves phase deuteride Ce Mn1.5 Al0.5 Dx (0<x<4) investigated by in situ neutron diffraction","Journal of Alloys Compd.","2000","306","","203","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521079","4.5253","","4.5253","","4.7214","","90","","90","","120","","83.733","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Sr Al2 D2","","- Al2 D2 Sr -","- Al2 D2 Sr -","- Al2 D2 Sr -","1","0.0833333","","Gingl, F.; Vogt, T.; Akiba, E.","Trigonal Sr Al2 H2: the first Zintl phase hydride","Journal of Alloys Compd.","2000","306","","127","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521150","10.6249","","10.3414","","7.5536","","90","","130.745","","90","","628.797","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","K Y (W2 O8)","","- K O8 W2 Y -","- K O8 W2 Y -","- K4 O32 W8 Y4 -","4","0.5","","Gallucci, E.; Goutaudier, C.; Hansen, T.; Cohen-Addad, M.T.; Mentzen, U.O.F.","A neutron diffraction study of nonstoichiometric alpha-(K Y W2 O8)","Journal of Alloys Compd.","2000","306","","227","234","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521662","6.667","","13.01","","15.39","","90","","90","","90","","1334.89","","","","","","","","","","","","","3","I b a m","-I 2 2c","72","","Cs2 Cd3 Te4","","- Cd3 Cs2 Te4 -","- Cd3 Cs2 Te4 -","- Cd12 Cs8 Te16 -","4","0.25","","Narducci, A.A.; Ibers, J.A.","Syntheses, crystal structures, and band gaps of Cs2 Cd3 Te4 and Rb2 Cd3 Te4","Journal of Alloys Compd.","2000","306","","170","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","141875","2020-10-21","18:00:00",""
"1521663","14.424","","15.35","","12.864","","90","","116.249","","90","","2554.49","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Rb2 Cd3 Te4","","- Cd3 Rb2 Te4 -","- Cd3 Rb2 Te4 -","- Cd24 Rb16 Te32 -","8","1","","Narducci, A.A.; Ibers, J.A.","Syntheses, crystal structures, and band gaps of Cs2 Cd3 Te4 and Rb2Cd3 Te4","Journal of Alloys Compd.","2000","306","","170","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","141876","2020-10-21","18:00:00",""
"1521778","6.785","","6.831","","10.629","","100.07","","91.98","","119.46","","418.134","","","","","","","","","","","","","4","P -1","-P 1","2","","Ba (B5 O8 (O H)) (H2 O)","","- B5 Ba H3 O10 -","- B5 Ba O10 -","- B10 Ba2 O20 -","2","1","","Pushcharovskii, D.Yu.; Ferro, O.; Merlino, S.; Dimitrova, O.V.; Vinogradova, S.A.","The crystal structures of two new Ba borates: pentaborate hydrate, Ba (B5 O8 (O H)) . (H2 O), and decaborate, Li Ba2 (B10 O16 (O H)3)","Journal of Alloys Compd.","2000","306","","163","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521779","6.732","","11.369","","11.581","","119.31","","90.11","","73.08","","728.868","","","","","","","","","","","","","5","P -1","-P 1","2","","Li Ba2 (B10 O16 (O H)3)","","- B10 Ba2 H3 Li O19 -","- B10 Ba2 Li O19 -","- B20 Ba4 Li2 O38 -","2","1","","Pushcharovskii, D.Yu.; Vinogradova, S.A.; Merlino, S.; Ferro, O.; Dimitrova, O.V.","The crystal structures of two new Ba borates: pentaborate hydrate, Ba (B5 O8 (O H)) . (H2 O), and decaborate, Li Ba2 (B10 O16 (O H)3)","Journal of Alloys Compd.","2000","306","","163","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521791","5.531","","5.531","","13.363","","90","","90","","120","","354.032","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La6 Mn6 O18 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521793","5.527","","5.527","","13.355","","90","","90","","120","","353.308","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.717 Sr0.167) (Mn (O2.583 F0.333))","","- F0.333 La0.717 Mn O2.583 Sr0.167 -","- F0.333 La0.72 Mn O2.583 Sr0.17 -","- F1.998 La4.32 Mn6 O15.498 Sr1.02 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521795","5.511","","5.511","","13.356","","90","","90","","120","","351.292","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.667 Sr0.317) (Mn (O2.333 F0.633))","","- F0.633 La0.667 Mn O2.333 Sr0.317 -","- F0.633 La0.667 Mn O2.334 Sr0.32 -","- F3.798 La4.002 Mn6 O14.004 Sr1.92 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521797","5.496","","5.496","","13.359","","90","","90","","120","","349.46","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.633 Sr0.35) (Mn (O1.967 F0.967))","","- F0.967 La0.633 Mn O1.967 Sr0.35 -","- F0.966 La0.633 Mn O1.968 Sr0.35 -","- F5.796 La3.798 Mn6 O11.808 Sr2.1 -","6","0.166667","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521799","5.51","","5.461","","7.74","","90","","90","","90","","232.897","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.325 Sr0.65) (Mn O (O1.375 F0.575))","","- F0.575 La0.325 Mn O2.375 Sr0.65 -","- F0.574 La0.325 Mn O2.38 Sr0.65 -","- F2.296 La1.3 Mn4 O9.52 Sr2.6 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521801","5.514","","5.46","","7.723","","90","","90","","90","","232.512","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.275 Sr0.65) (Mn O (O1.325 F0.625))","","- F0.625 La0.275 Mn O2.325 Sr0.65 -","- F0.62 La0.28 Mn O2.324 Sr0.65 -","- F2.48 La1.12 Mn4 O9.296 Sr2.6 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521803","5.506","","5.457","","7.711","","90","","90","","90","","231.687","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(La0.275 Sr0.7) (Mn O (O1.175 F0.775))","","- F0.775 La0.275 Mn O2.175 Sr0.7 -","- F0.774 La0.275 Mn O2.18 Sr0.7 -","- F3.096 La1.1 Mn4 O8.72 Sr2.8 -","4","0.5","","Quo, Y.-Q.; Zhang, X.-H.; Waeppling, R.","Crystal structure of La1-x Srx Mn O3-2x+d F2x","Journal of Alloys Compd.","2000","306","","133","140","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"6000764","11.097","","11.097","","23.88","","90","","90","","120","","2546.69","","","","","","","","","","","","","2","R???","","","","","","- B18 Si -","","","","","","Imai, M.; Kimura, T.; Sato, K.; Hirano, T.","Single-crystal growth and electrical properties of BnSi (n=18)","Journal of Alloys and Compounds","2000","306","","197","202","10.1016/S0925-8388(00)00813-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""