# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-01T06:24:37+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 = 85 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
"1509623","12.238","","12.238","","12.238","","90","","90","","90","","1832.87","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ag12 (Si12 Al12 O48)","","- Ag11.06 Al12 O48 Si12 -","- Ag11.06 Al12 O48 Si12 -","- Ag11.06 Al12 O48 Si12 -","1","0.0208333","","Uytterhoeven, J.B.; Gellens, L.R.; Mortier, W.J.; Schoonheydt, R.A.","The nature of charged silver clusters in dehydrated zeolites of type A","Journal of Physical Chemistry","1981","85","","2783","2788","10.1021/j150619a018","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1530264","12.146","","12.146","","12.146","","90","","90","","90","","1791.84","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cu7.52 (Al12 Si12 O48) O3 H5.76","","- Al12 Cu7.52 H5.76 O51 Si12 -","- Al12 Cu7.52 O51 Si12 -","- Al12 Cu7.52 O51 Si12 -","1","0.0208333","","Lee, H.S.; Seff, K.","Redox reactions of copper in zeolite A. Four crystal structures of vacuum-desolvated copper-exchanged zeolite A, Cu8-A","Journal of Physical Chemistry","1981","85","","397","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530265","12.176","","12.176","","12.176","","90","","90","","90","","1805.15","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cu8 (O H)2.25 (Al12 Si12 O48)","","- Al12 Cu8 H2.25 O50.25 Si12 -","- Al12 Cu8 O50.24 Si12 -","- Al12 Cu8 O50.24 Si12 -","1","0.0208333","","Lee, H.S.; Seff, K.","Redox reactions of copper in zeolite A. Four crystal structures of vacuum-desolvated copper-exchanged zeolite A, Cu8-A","Journal of Physical Chemistry","1981","85","","397","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530266","12.192","","12.192","","12.192","","90","","90","","90","","1812.28","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cu7.56 (O H)1.35 Al12 Si12 O48 H3.68","","- Al12 Cu7.56 H5.03 O49.35 Si12 -","- Al12 Cu7.56 O49.36 Si12 -","- Al12 Cu7.56 O49.36 Si12 -","1","0.0208333","","Lee, H.S.; Seff, K.","Redox reactions of copper in zeolite A. Four crystal structures of vacuum-desolvated copper-exchanged zeolite A, Cu8-A","Journal of Physical Chemistry","1981","85","","397","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530267","12.208","","12.208","","12.208","","90","","90","","90","","1819.42","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Cu5.68 (Al12 Si12 O48)","","- Al12 Cu5.68 O48 Si12 -","- Al12 Cu5.68 O48 Si12 -","- Al12 Cu5.68 O48 Si12 -","1","0.0208333","","Lee, H.S.; Seff, K.","Redox reactions of copper in zeolite A. Four crystal structures of vacuum-desolvated copper-exchanged zeolite A, Cu8-A","Journal of Physical Chemistry","1981","85","","397","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","155338","2020-10-21","18:00:00",""
"1530381","12.23","","12.23","","12.23","","90","","90","","90","","1829.28","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cd5.86 (Al12.29 Si11.71 O48) (H2 O)34.5","","- Al12.29 Cd5.86 H69 O82.5 Si11.71 -","- Al12.288 Cd5.86 O82.5008 Si11.712 -","- Al12.288 Cd5.86 O82.5008 Si11.712 -","1","0.0208333","","McCusker, L.B.; Seff, K.","Crystal structures of hydrated and partially dehydrated fully cadmium(II)-exchanged zeolite A","Journal of Physical Chemistry","1981","85","","166","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530382","12.24","","12.24","","12.24","","90","","90","","90","","1833.77","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cd6 Al12 Si12 O48 (H2 O)6","","- Al12 Cd6 H12 O54 Si12 -","- Al12 Cd5.9504 O53.9996 Si12 -","- Al12 Cd5.9504 O53.9996 Si12 -","1","0.0208333","","McCusker, L.B.; Seff, K.","Crystal structures of hydrated and partially dehydrated fully cadmium(II)-exchanged zeolite A","Journal of Physical Chemistry","1981","85","","166","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""