# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T15:58:20+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 Chemical Physics') AND volume = 48 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
"1008190","5.4537","","4.857","","8.1734","","90","","107.367","","90","","206.6","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Lithium sulfate hydrate","","- H2 Li2 O5 S -","- H2 Li2 O5 S -","- H4 Li4 O10 S2 -","2","1","","Smith, H G; Peterson, S W; Levy, H A","Neutron-diffraction study of lithium sulfate monohydrate","Journal of Chemical Physics","1968","48","","5561","5565","10.1063/1.1668257","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1509387","4.58","","4.58","","6","","90","","90","","90","","125.858","","","","","","","","","","","","","2","P 4/n :1","P 4ab -1ab","85","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.25","","Kasper, J.S.; Moore, M.J.","Crystal Structure of Ag I at 3 kbar","Journal of Chemical Physics","1968","48","","2446","2450","10.1063/1.1669466","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510469","3.707","","3.707","","8.987","","90","","90","","90","","123.498","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Au2 Tb -","- Au2 Tb -","- Au4 Tb2 -","2","0.0625","","Atoji, M.","Magnetic structures of Tb Au2","Journal of Chemical Physics","1968","48","","560","564","10.1063/1.1668683","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523290","3.892","","3.892","","3.892","","90","","90","","90","","58.955","","","","","","","","","","","","","2","I m -3 m","-I 4 2 3","229","","(Pb0.64 Sb0.36)","","- Pb0.64 Sb0.36 -","- Pb0.64 Sb0.36 -","- Pb1.28 Sb0.72 -","2","0.0208333","","Borromee-Gautier, C.; Giessen, B.C.; Grant, N.J.","Metastable phases in the Pb-Sb and Pb-Bi systems","Journal of Chemical Physics","1968","48","","1905","1911","","","","","","","","","","","","","","","","","","","","","","has coordinates","143904","2020-10-21","18:00:00",""
"1527106","6.393","","5.582","","8.963","","90","","90","","90","","319.851","","","","","","","","","","","","","2","C m c a","-C 2ac 2","64","","","","- C S2 -","- C S2 -","- C4 S8 -","4","","","Baenziger, N.C.; Duax, W.L.","Crystal structure and molecular motion of solid carbon disulfide","Journal of Chemical Physics","1968","48","","2974","2981","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537866","4.907","","4.907","","4.907","","90","","90","","90","","118.154","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Pb3.33 Sb0.7 -","- Pb3.3 Sb0.7 -","- Pb3.3 Sb0.7 -","1","0.00520833","","Borromee-Gautier, C.; Giessen, B.C.; Grant, N.J.","Metastable phases in the Pb-Sb and Pb-Bi systems","Journal of Chemical Physics","1968","48","","1905","1911","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1542037","8.916","","7.832","","9.425","","90","","93.65","","90","","656.814","","","","","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","Ba (Cl O3)2 (H2 O)","","- Ba Cl2 H2 O7 -","- Ba Cl2 H2 O7 -","- Ba4 Cl8 H8 O28 -","4","0.5","","Sikka, S.K.; Momin, S.N.; Rajagopal, H.; Chidambaram, R.","Neutron-diffraction Refinement of the Crystal Structure of Barium Chlorate Monohydrate Ba (Cl O3)2 H2 O","Journal of Chemical Physics","1968","48","","1883","1890","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""