# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-26T11:12:53+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 = 83 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
"1530597","12.317","","12.317","","12.317","","90","","90","","90","","1868.59","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","K11.1 (Al12 Si12 O48)","","- Al12 K11.1 O48 Si12 -","- Al12 K11.06 O48 Si12 -","- Al12 K11.06 O48 Si12 -","1","0.0208333","","Pluth, J.J.; Smith, J.V.","Crystal structure of dehydrated potassium-exchanged zeolite A. Absence of supposed zero-coordinated potassium. Refinement of Si, Al-ordered superstructure","Journal of Physical Chemistry","1979","83","","741","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","155731","2020-10-21","18:00:00",""
"1530598","12.3","","12.3","","12.3","","90","","90","","90","","1860.87","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","K11.41 (Al12 Si12 O48)","","- Al12 K11.41 O48 Si12 -","- Al12 K11.414 O48 Si12 -","- Al12 K11.414 O48 Si12 -","1","0.0208333","","Pluth, J.J.; Smith, J.V.","Crystal structure of dehydrated potassium-exchanged zeolite A. Absence of supposed zero-coordinated potassium. Refinement of Si, Al-ordered superstructure","Journal of Physical Chemistry","1979","83","","741","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","155732","2020-10-21","18:00:00",""
"1530839","12.312","","12.312","","12.312","","90","","90","","90","","1866.32","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cs9.24 Tl2.98 Si12 Al12 O48","","- Al12 Cs9.24 O48 Si12 Tl2.98 -","- Al12 Cs9.2397 O48 Si12 Tl2.96 -","- Al12 Cs9.2397 O48 Si12 Tl2.96 -","1","0.0208333","","Subramanian, V.; Seff, K.","Crystal structure of dehydrated cesium- and thalliumexchanged zeolite A","Journal of Physical Chemistry","1979","83","","2166","2169","","","","","","","","","","","","","","","","","","","","","","has coordinates","156055","2020-10-21","18:00:00",""
"1536625","12.309","","12.309","","12.309","","90","","90","","90","","1864.95","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","K12 (Al12 Si12 O48)","","- Al12 K11 O42 Si12 -","- Al12 K11 O48 Si12 -","- Al12 K11 O48 Si12 -","1","0.0208333","","Pluth, J.J.; Smith, J.V.","Crystal structure of dehydrated potassium-exchanged zeolite A. Absence of supposed zero-coordinated potassium. Refinement of Si, Al-ordered superstructure","Journal of Physical Chemistry","1979","83","","741","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","164409","2020-10-21","18:00:00",""
"1541544","24.6","","24.6","","24.6","","90","","90","","90","","14886.9","","","","","","","","","","","","","4","F m -3 c","-F 4a 2 3","226","","K91 Al96 Si96 O384","","- Al96 K91 O384 Si96 -","- Al96 K91.056 O384 Si96 -","- Al96 K91.056 O384 Si96 -","1","0.00520833","","Pluth, J.J.; Smith, J.V.","Crystal structure of dehydrated potassium-exchanged zeolite A. Absence of supposed zero-coordinated potassium. Refinement of Si, Al-ordered superstructure","Journal of Physical Chemistry","1979","83","","741","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","172895","2020-10-21","18:00:00",""