# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-14T11:56:50+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 = 56 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
"1527817","7.01","","7.01","","6.19","","90","","90","","90","","304.177","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Lu (V O4)","","- Lu O4 V -","- Lu O4 V -","- Lu4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527818","7.04","","7.04","","6.23","","90","","90","","90","","308.769","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Yb (V O4)","","- O4 V Yb -","- O4 V Yb -","- O16 V4 Yb4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527819","7","","7","","6.2","","90","","90","","90","","303.8","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Tm (V O4)","","- O4 Tm V -","- O4 Tm V -","- O16 Tm4 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527820","7.06","","7.06","","6.25","","90","","90","","90","","311.522","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Ho (V O4)","","- Ho O4 V -","- Ho O4 V -","- Ho4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527821","7.1","","7.1","","6.27","","90","","90","","90","","316.071","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Y (V O4)","","- O4 V Y -","- O4 V Y -","- O16 V4 Y4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527822","7.1","","7.1","","6.27","","90","","90","","90","","316.071","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Dy (V O4)","","- Dy O4 V -","- Dy O4 V -","- Dy4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527823","7.15","","7.15","","6.31","","90","","90","","90","","322.583","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Tb (V O4)","","- O4 Tb V -","- O4 Tb V -","- O16 Tb4 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527824","7.19","","7.19","","6.33","","90","","90","","90","","327.236","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Gd (V O4)","","- Gd O4 V -","- Gd O4 V -","- Gd4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527825","7.2","","7.2","","6.35","","90","","90","","90","","329.184","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Eu (V O4)","","- Eu O4 V -","- Eu O4 V -","- Eu4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527826","7.24","","7.24","","6.36","","90","","90","","90","","333.376","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Sm (V O4)","","- O4 Sm V -","- O4 Sm V -","- O16 Sm4 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527827","7.33","","7.33","","6.43","","90","","90","","90","","345.477","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Nd (V O4)","","- Nd O4 V -","- Nd O4 V -","- Nd4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527828","7.3","","7.3","","6.42","","90","","90","","90","","342.122","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Pr (V O4)","","- O4 Pr V -","- O4 Pr V -","- O16 Pr4 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527829","7.34","","7.34","","6.47","","90","","90","","90","","348.575","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","Ce (V O4)","","- Ce O4 V -","- Ce O4 V -","- Ce4 O16 V4 -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527830","7.07","","7.07","","6.25","","90","","90","","90","","312.406","","","","","","","","","","","","","4","I 41/a m d :1","I 4bw 2bw -1bw","141","","(Er.75 Y.25) (V O4)","","- Er0.75 O4 V Y0.25 -","- Er0.75 O4 V Y0.25 -","- Er3 O16 V4 Y -","4","0.125","","Milligan, W.O.; Vernon, L.W.","Crystal structure of heavy metal orthovanadates","Journal of Physical Chemistry","1952","56","","145","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""