# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-01T03:52:32+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 'Journal of Physics: Condensed Matter') AND volume = 15 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
"1532782","5.467038","","5.51048","","7.751242","","90","","90.1199","","90","","233.513","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 (Ni Mn O6)","","- La2 Mn Ni O6 -","- La2 Mn Ni O6 -","- La4 Mn2 Ni2 O12 -","2","0.5","","Bull, C.L.; Gleeson, D.; Knight, K.S.","Determination of B-site ordering and structural transformations in the mixed transition metal perovskites La2 Co Mn O6 and La2 Ni Mn O6","Journal of Physics: Condensed Matter","2003","15","","4927","4936","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532786","5.525192","","5.487598","","7.778682","","90","","89.9495","","90","","235.85","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 (Co Mn O6)","","- Co La2 Mn O6 -","- Co La2 Mn O6 -","- Co2 La4 Mn2 O12 -","2","0.5","","Bull, C.L.; Gleeson, D.; Knight, K.S.","Determination of B-site ordering and structural transformations in the mixed transition metal perovskites La2 Co Mn O6 and La2 Ni Mn O6","Journal of Physics: Condensed Matter","2003","15","","4927","4936","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532790","5.47456","","5.47456","","5.47456","","60.6712","","60.6712","","60.6712","","117.778","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","La2 (Ni Mn O6)","","- La2 Mn Ni O6 -","- La2 Mn Ni O6 -","- La2 Mn Ni O6 -","1","0.166667","","Bull, C.L.; Gleeson, D.; Knight, K.S.","Determination of B-site ordering and structural transformations in the mixed transition metal perovskites La2 Co Mn O6 and La2 Ni Mn O6","Journal of Physics: Condensed Matter","2003","15","","4927","4936","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532794","5.487977","","5.487977","","5.487977","","60.7239","","60.7239","","60.7239","","118.784","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","La2 (Co Mn O6)","","- Co La2 Mn O6 -","- Co La2 Mn O6 -","- Co La2 Mn O6 -","1","0.166667","","Bull, C.L.; Gleeson, D.; Knight, K.S.","Determination of B-site ordering and structural transformations in the mixed transition metal perovskites La2 Co Mn O6 and La2 Ni Mn O6","Journal of Physics: Condensed Matter","2003","15","","4927","4936","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532855","3.913","","3.913","","10.507","","90","","90","","90","","160.879","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","U Cr2 Si2","","- Cr2 Si2 U -","- Cr2 Si2 U -","- Cr4 Si4 U2 -","2","0.0625","","Matsuda, T.D.; Metoki, N.; Yamamoto, E.; Haga, Y.; Ikeda, S.; Kaneko, K.; Onuki, Y.","Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2 Si2","Journal of Physics: Condensed Matter","2003","15","","S2023","S2027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532856","3.906","","3.903","","10.506","","91.49","","88.51","","90.74","","160.045","","","","","","","","","","","","","3","P -1","-P 1","2","","U Cr2 Si2","","- Cr2 Si2 U -","- Cr2 Si2 U -","- Cr4 Si4 U2 -","2","1","","Matsuda, T.D.; Onuki, Y.; Metoki, N.; Ikeda, S.; Kaneko, K.; Haga, Y.; Yamamoto, E.","Crystal and magnetic structure in the itinerant 5f antiferromagnet U Cr2 Si2","Journal of Physics: Condensed Matter","2003","15","","S2023","S2027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533104","9.326","","9.288","","2.7555","","90","","90","","90","","238.681","","","","","","","","","","","","","2","B b m m","-B 2 2b","63","","","","- Fe3 O4 -","- Fe3 O4 -","- Fe12 O16 -","4","0.25","","Dubrovinskii, L.S.; Dubrovinskaya, N.A.; McCammon, C.; Dmitriev, V.; Rozenberg, G.Kh.; Le Bihan, T.; Osorio-Guillen, J.M.; Johansson, B.; Weber, H.P.","The structure of the metallic high-pressure Fe3 O4 polymorph: experimental and theoretical study","Journal of Physics: Condensed Matter","2003","15","","7697","7706","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1533146","5.9772","","7.5095","","5.2311","","90","","90","","90","","234.802","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Cu0.75 Mn0.25) (Se O3)","","- Cu0.75 Mn0.25 O3 Se -","- Cu0.75 Mn0.25 O3 Se -","- Cu3 Mn O12 Se4 -","4","0.5","","Escamilla, R.; Duran, A.; Alario-Franco, M.A.; Moran, E.; Rosales, M.I.","The effect of Mn substitution on the structure and magnetic properties of Se (Cu1-x Mnx) O3 solid solution","Journal of Physics: Condensed Matter","2003","15","","1951","1961","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533147","6.0044","","7.6581","","5.1954","","90","","90","","90","","238.896","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Cu0.5 Mn0.5) (Se O3)","","- Cu0.5 Mn0.5 O3 Se -","- Cu0.5 Mn0.5 O3 Se -","- Cu2 Mn2 O12 Se4 -","4","0.5","","Escamilla, R.; Duran, A.; Rosales, M.I.; Moran, E.; Alario-Franco, M.A.","The effect of Mn substitution on the structure and magnetic properties of Se (Cu1-x Mnx) O3 solid solution","Journal of Physics: Condensed Matter","2003","15","","1951","1961","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533148","6.069","","7.8299","","5.1538","","90","","90","","90","","244.907","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Cu0.25 Mn0.75) (Se O3)","","- Cu0.25 Mn0.75 O3 Se -","- Cu0.25 Mn0.75 O3 Se -","- Cu Mn3 O12 Se4 -","4","0.5","","Escamilla, R.; Duran, A.; Rosales, M.I.; Moran, E.; Alario-Franco, M.A.","The effect of Mn substitution on the structure and magnetic properties of Se (Cu1-x Mnx) O3 solid solution","Journal of Physics: Condensed Matter","2003","15","","1951","1961","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533149","6.0937","","7.8651","","5.1434","","90","","90","","90","","246.511","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Mn (Se O3)","","- Mn O3 Se -","- Mn O3 Se -","- Mn4 O12 Se4 -","4","0.5","","Escamilla, R.; Duran, A.; Moran, E.; Rosales, M.I.; Alario-Franco, M.A.","The effect of Mn substitution on the structure and magnetic properties of Se (Cu1-x Mnx) O3 solid solution","Journal of Physics: Condensed Matter","2003","15","","1951","1961","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533206","5.4169","","5.4169","","8.3976","","90","","90","","90","","246.409","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Sr2 (Cu W O6)","","- Cu O6 Sr2 W -","- Cu O6 Sr2 W -","- Cu2 O12 Sr4 W2 -","2","0.125","","Gateshki, M.; Igartua, J.M.","Second-order structural phase transition in Sr2 Cu W O6 double-perovskite oxide","Journal of Physics: Condensed Matter","2003","15","","6749","6757","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1533445","8.5301","","8.5301","","12.4348","","90","","90","","120","","783.57","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Sm2 Fe12 Co5 C0.75","","- C0.75 Co5 Fe12 Sm2 -","- C0.75 Co4.998 Fe12.002 Sm2 -","- C2.25 Co14.994 Fe36.006 Sm6 -","3","0.0833333","","Altounian, Z.; Liu Xubo; Girt, E.","Formation, structure and hard magnetic properties of Sm2 Fe17-x Cox Cy compounds","Journal of Physics: Condensed Matter","2003","15","","3315","3322","","","","","","","","","","","","","","","","","","","","","","has coordinates","159689","2020-10-21","18:00:00",""
"1533546","7.7088","","7.7088","","4.1496","","90","","90","","120","","213.555","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","La2 Zn6 Ge3","","- Ge3 La2 Zn6 -","- Ge3 La2 Zn6 -","- Ge3 La2 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Daoud-Aladine, A.; Berger, S.; Bauer, E.; Hilscher, G.; Noel, H.; Paul, C.; Michor, H.; Rogl, P.; Keller, L.; Roisnel, T.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE= La, Ce, Pr, Nd, Sm, Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159800","2020-10-21","18:00:00",""
"1533550","7.6769","","7.6769","","4.1159","","90","","90","","120","","210.072","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Ce2 Zn6 Ge3","","- Ce2 Ge3 Zn6 -","- Ce2 Ge3 Zn6 -","- Ce2 Ge3 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Roisnel, T.; Bauer, E.; Hilscher, G.; Berger, S.; Paul, C.; Michor, H.; Rogl, P.; Daoud-Aladine, A.; Keller, L.; Noel, H.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE = La, Ce, Pr, Nd, Sm,Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159804","2020-10-21","18:00:00",""
"1533554","7.6543","","7.6543","","4.0984","","90","","90","","120","","207.949","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Pr2 Zn6 Ge3","","- Ge3 Pr2 Zn6 -","- Ge3 Pr2 Zn6 -","- Ge3 Pr2 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Bauer, E.; Noel, H.; Berger, S.; Michor, H.; Rogl, P.; Paul, C.; Hilscher, G.; Daoud-Aladine, A.; Roisnel, T.; Keller, L.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE = La, Ce, Pr, Nd, Sm,Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159808","2020-10-21","18:00:00",""
"1533558","7.6378","","7.6378","","4.0817","","90","","90","","120","","206.209","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Nd2 Zn6 Ge3","","- Ge3 Nd2 Zn6 -","- Ge3 Nd2 Zn6 -","- Ge3 Nd2 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Bauer, E.; Berger, S.; Hilscher, G.; Michor, H.; Paul, C.; Daoud-Aladine, A.; Roisnel, T.; Rogl, P.; Keller, L.; Noel, H.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE = La, Ce, Pr, Nd, Sm,Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159812","2020-10-21","18:00:00",""
"1533562","7.6119","","7.6119","","4.0519","","90","","90","","120","","203.318","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Sm2 Zn6 Ge3","","- Ge3 Sm2 Zn6 -","- Ge3 Sm2 Zn6 -","- Ge3 Sm2 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Bauer, E.; Roisnel, T.; Hilscher, G.; Berger, S.; Michor, H.; Daoud-Aladine, A.; Paul, C.; Noel, H.; Rogl, P.; Keller, L.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE = La, Ce, Pr, Nd, Sm,Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159816","2020-10-21","18:00:00",""
"1533566","7.5939","","7.5939","","4.0295","","90","","90","","120","","201.239","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Gd2 Zn6 Ge3","","- Gd2 Ge3 Zn6 -","- Gd2 Ge3 Zn6 -","- Gd2 Ge3 Zn6 -","1","0.0833333","","Grytsiv, A.V.; Noel, H.; Berger, S.; Bauer, E.; Michor, H.; Keller, L.; Hilscher, G.; Rogl, P.; Paul, C.; Roisnel, T.; Daoud-Aladine, A.","Novel (Zn9)-cluster compounds RE2 Zn6 Ge3 (RE = La, Ce, Pr, Nd, Sm,Gd): crystal structure and physical properties","Journal of Physics: Condensed Matter","2003","15","","3053","3067","","","","","","","","","","","","","","","","","","","","","","has coordinates","159820","2020-10-21","18:00:00",""
"1533741","12.32108","","12.32108","","12.32108","","90","","90","","90","","1870.45","","","","","","","","","","","","","4","P m -3","-P 2 2 3","200","","Al78.2 Si9.7 Cu32.5 Fe16","","- Al78.2 Cu32.5 Fe16 Si9.7 -","- Al78.168 Cu32.53 Fe16.02 Si9.672 -","- Al78.168 Cu32.53 Fe16.02 Si9.672 -","1","0.0416667","","Stadnik, Z.M.; Takeuchi, T.; Tanaka, N.; Mizutani, U.","Structural, Mossbauer and transport studies of the icosahedral quasicrystals Al55 Si7 Cu25.5 Fe12.5, Al62.5 Cu24.5 Fe13 and the crystalline 1/1 approximant Al55 Si7 Cu25.5 Fe12.5","Journal of Physics: Condensed Matter","2003","15","","6365","6380","","","","","","","","","","","","","","","","","","","","","","has coordinates","160010","2020-10-21","18:00:00",""