# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-10T19:54:56+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 Physical Chemistry') AND volume = 91 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
"1509972","12.311","","12.311","","12.311","","90","","90","","90","","1865.86","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Ag7.6 Na4.4 (Al12 Si12 O48)","","- Ag7.6 Al12 Na4.4 O48 Si12 -","- Ag7.5996 Al12 Na4.4 O48 Si12 -","- Ag7.5996 Al12 Na4.4 O48 Si12 -","1","0.0208333","","Seff, K.; Kim, Y.","Crystal structure of fully dehydrated, partially Ag+ exchanged zeolite 4A, Ag7.6 Na4.4 -A. Ag+ ions prefer 6-ring sites. One Ag+ ion is reduced.","Journal of Physical Chemistry","1987","91","","671","674","10.1021/j100287a035","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1540075","12.279","","12.279","","12.279","","90","","90","","90","","1851.35","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Cs12.94 (Al12 Si12 O48)","","- Al12 Cs12.94 O48 Si12 -","- Al12 Cs12.94 O48 Si12 -","- Al12 Cs12.94 O48 Si12 -","1","0.0208333","","Heo, N.-H.; Dejsupa, C.; Seff, K.","Preparation and structure of fully Cs+ -exchanged zeolite A","Journal of Physical Chemistry","1987","91","","3943","3944","","","","","","","","","","","","","","","","","","","","","","has coordinates","169242","2020-10-21","18:00:00",""
"1540076","12.279","","12.279","","12.279","","90","","90","","90","","1851.35","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cs13 (Al12 Si12 O48) (O H)","","- Al12 Cs13 H O49 Si12 -","- Al12 Cs13.0008 O48 Si12 -","- Al12 Cs13.0008 O48 Si12 -","1","0.0208333","","Heo, N.-H.; Dejsupa, C.; Seff, K.","Preparation and structure of fully Cs+ -exchanged zeolite A","Journal of Physical Chemistry","1987","91","","3943","3944","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540244","12.208","","12.208","","12.208","","90","","90","","90","","1819.42","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Ag4.6 Na7.4 (Al12 Si12 O48)","","- Ag4.6 Al12 Na7.4 O48 Si12 -","- Ag4.508 Al12 Na7.4 O48 Si12 -","- Ag4.508 Al12 Na7.4 O48 Si12 -","1","0.0208333","","Kim, Y.; Seff, K.","Silver cluster formation in the large cavity of zeolite A. Crystal structure of Ag4.6 Na7.4 Si12 Al12 O48. Dehydrated and treated with hydrogen at 350 centigrade","Journal of Physical Chemistry","1987","91","","668","671","","","","","","","","","","","","","","","","","","","","","","has coordinates","169484","2020-10-21","18:00:00",""