# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-27T04:47:48+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 C') AND volume = 14 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
"1509178","5.5871","","5.5871","","22.5131","","90","","90","","120","","608.61","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ag Al11 O17 -","- Ag0.9999 Al11 O16.9999 -","- Ag1.9998 Al22 O33.9998 -","2","0.0833333","","Tofield, B.C.; Newsam, J.M.","A powder neutron diffraction study of stoichiometric silver beta alumina at 4.2 K","Journal of Physics C","1981","14","","1545","1554","10.1088/0022-3719/14/11/016","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1511652","11.955","","11.955","","11.955","","90","","90","","90","","1708.63","","","","","","","","","","","","","4","F -4 3 c","F -4a 2 3","219","","Cu3 (B7 O13 Br)","","- B7 Br Cu3 O13 -","- B7 Br Cu3 O13 -","- B56 Br8 Cu24 O104 -","8","0.0833333","","Nelmes, R.J.; Hay, W.J.","Structural studies of boracites- VI. The cubic phase of cobalt iodine boracite, Co3 B7 O13 I, and of copper bromine boracite Cu3 B7 O13 Br","Journal of Physics C","1981","14","","5247","5257","10.1088/0022-3719/14/34/007","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511656","12.491","","12.491","","12.491","","90","","90","","90","","1948.91","","","","","","","","","","","","","4","F -4 3 c","F -4a 2 3","219","","Cd3 B7 O13 S2","","- B7 Cd2.988 O12.765 S1.88 -","- B7 Cd2.988 O12.765 S1.88 -","- B56 Cd23.904 O102.12 S15.04 -","8","0.0833333","","Nelmes, R.J.; Gould, S.E.B.; Gould, R.O.","Structural studies of boracites. VII. Cadmium sulphur boracite at room temperature","Journal of Physics C","1981","14","","5259","5267","10.1088/0022-3719/14/34/008","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1530077","7.982","","7.982","","7.889","","90","","90","","90","","502.627","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","Cs D2 As O4","","- As Cs D2 O4 -","- As Cs D2 O4 -","- As4 Cs4 D8 O16 -","4","0.25","","Hay, W.J.; Nelmes, R.J.","Structural studies of deuterated Cs H2 As O4 in its paraelectric and ferroelectric phases","Journal of Physics C","1981","14","","1043","1052","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530078","11.516","","11.103","","7.87","","90","","90","","90","","1006.28","","","","","","","","","","","","","4","F d d 2","F 2 -2d","43","","Cs D2 (As O4)","","- As Cs D2 O4 -","- As Cs D2 O4 -","- As8 Cs8 D16 O32 -","8","0.5","","Hay, W.J.; Nelmes, R.J.","Structural studies of deuterated Cs H2 As O 4 in its paraelectric and ferroelectric phases","Journal of Physics C","1981","14","","1043","1052","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530111","5.605","","5.605","","5.605","","90","","90","","90","","176.087","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Cs Pb Cl3","","- Cl3 Cs Pb -","- Cl3 Cs Pb -","- Cl3 Cs Pb -","1","0.0208333","","Hutton, J.; Nelmes, R.J.","High-resolution studies of cubic Perovskites by elastic neutron diffraction II - Sr Ti O3, K Mn F3, Rb Ca F3 and Cs Pb Cl3","Journal of Physics C","1981","14","","1713","1736","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530112","4.445","","4.445","","4.445","","90","","90","","90","","87.824","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Rb Ca F3","","- Ca F3 Rb -","- Ca F3 Rb -","- Ca F3 Rb -","1","0.0208333","","Hutton, J.; Nelmes, R.J.","High-resolution studies of cubic Perovskites by elastic neutron diffraction II - Sr Ti O3, K Mn F3, Rb Ca F3 and Cs Pb Cl3","Journal of Physics C","1981","14","","1713","1736","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:09",""
"1530470","4.334","","14.024","","10.013","","90","","90","","90","","608.59","","","","","","","","","","","","","2","C m c m","-C 2c 2","63","","U I3","","- I3 U -","- I3 U -","- I12 U4 -","4","0.25","","Murasik, A.; Fischer, P.; Szczepaniak, W.","Neutron diffraction study of long-range antiferromagnetic order and crystal structure of uranium (III) tri-iodide","Journal of Physics C","1981","14","","1847","1854","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""