# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T17:42:35+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 = 70 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
"1530503","7.442","","17.307","","8.077","","90","","90","","90","","1040.31","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","Cs2 Fe Cl5 (H2 O)","","- Cl5 Cs2 Fe H2 O -","- Cl5 Cs2 Fe O -","- Cl20 Cs8 Fe4 O4 -","4","0.25","","O'Connor, C.J.; Deaver, B.S.jr.; Sinn, E.","Crystal structures of A2 Fe Cl5 (H2 O) (A = Rb(+), Cs(+)) and field dependent superconducting susceptometer measurements","Journal of Chemical Physics","1979","70","","5161","5167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530504","13.825","","9.918","","7.1","","90","","90","","90","","973.526","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Rb2 Fe Cl5 (H2 O)","","- Cl5 Fe H2 O Rb2 -","- Cl5 Fe O Rb2 -","- Cl20 Fe4 O4 Rb8 -","4","0.5","","O'Connor, C.J.; Deaver, B.S.jr.; Sinn, E.","Crystal structures of A2 Fe Cl5 (H2 O) (A = Rb(+), Cs(+)) and field dependent superconducting susceptometer measurements","Journal of Chemical Physics","1979","70","","5161","5167","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530644","3.34","","3.34","","12.39","","90","","90","","120","","119.7","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- H0.76 Nb S2 -","- H0.76 Nb S2 -","- H1.52 Nb2 S4 -","2","0.0833333","","Riekel, C.; Reznik, H.G.; Schoellhorn, R.; Wright, C.J.","Neutron diffraction study on formation and structure of Dx Ta S2 and Hx Nb S2","Journal of Chemical Physics","1979","70","","5203","5212","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""