# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T15:28:43+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 'Acta Chemica Scandinavica A') AND volume = 31 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
"1527081","7.1067","","7.1067","","17.0867","","90","","90","","120","","747.351","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","Pd15 P2","","- P2 Pd15 -","- P2 Pd15 -","- P6 Pd45 -","3","0.166667","","Andersson, Y.","The crystal structure of Pd15 P2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","354","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","148386","2020-10-21","18:00:00",""
"1527138","5.464","","5.464","","5.464","","90","","90","","90","","163.129","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Sc As","","- As Sc -","- As Sc -","- As4 Sc4 -","4","0.0208333","","Berger, R.","Crystallographic data on new arsenides and antimonides of titanium and scandium","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","514","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527139","5.8517","","5.8517","","5.8517","","90","","90","","90","","200.376","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Sb Sc -","- Sb Sc -","- Sb4 Sc4 -","4","0.0208333","","Berger, R.","Crystallographic data on new arsenides and antimonides of titanium and scandium","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","514","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527140","10.2173","","8.3281","","7.1459","","90","","90","","90","","608.05","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Sb3 Ti5 -","- Sb3 Ti5 -","- Sb12 Ti20 -","4","0.5","","Berger, R.","Structure refinement of Ti5 Sb3 from single-crystal data","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","889","890","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527655","7.861","","7.861","","6.726","","90","","90","","120","","359.951","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cd Cs Br3","","- Br3 Cd Cs -","- Br3 Cd Cs -","- Br6 Cd2 Cs2 -","2","0.0833333","","Knakkergaard Moeller, C.","About the crystal structure of cesium cadmium tribromide and some observations on crystals of cesium cadmium trichloride","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","669","672","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527673","12.933","","7.334","","10.811","","90","","91.68","","90","","1024.99","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pr H3 (Se O3)2 (Se2 O5)","","- H3 O11 Pr Se4 -","- O11 Pr Se4 -","- O44 Pr4 Se16 -","4","1","","Koskenlinna, M.; Valkonen, J.","The crystal structure of Pr H3 (Se O3)2 (Se2 O5), a compound with selenite and diselenite groups","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","457","460","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527674","7.751","","10.33","","13.429","","90","","92.74","","90","","1074","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Mn2 (Se O3)3 (H2 O)3","","- H6 Mn2 O12 Se3 -","- Mn2 O12 Se3 -","- Mn8 O48 Se12 -","4","1","","Koskenlinna, M.; Valkonen, J.","Jahn-Teller distortions in the structure of manganese(III) selenite trihydrate, Mn2 (Se O3)3 (H2 O)3","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","611","614","","","","","","","","","","","","","","","","","","","","","","has coordinates","149361","2020-10-21","18:00:00",""
"1527675","7.451","","12.583","","7.575","","90","","92.82","","90","","709.341","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Mn H (Se O3) (Se2 O5)","","- H Mn O8 Se3 -","- Mn O8 Se3 -","- Mn4 O32 Se12 -","4","1","","Koskenlinna, M.; Valkonen, J.","Crystal structure of manganese(III) hydrogen selenite diselenite, Mn H (Se O3) (Se2 O5)","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","638","640","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527676","13.179","","5.826","","4.933","","90","","90","","90","","378.76","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Mn (Se O3) (D2 O)","","- D2 Mn O4 Se -","- Mn O4 Se -","- Mn4 O16 Se4 -","4","0.5","","Koskenlinna, M.; Valkonen, J.","The crystal structure of manganese(II) selenite monodeuterate","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","752","754","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527682","7.2","","7.2","","4.21","","90","","90","","90","","218.246","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(N D4)2 (Pd Cl4)","","- Cl4 D8 N2 Pd -","- Cl4 D8 N2 Pd -","- Cl4 D8 N2 Pd -","1","0.0625","","Krebs Larsen, F.; Berg, R.W.","A neutron diffraction study of the crystal structure of deuterated ammonium tetrachloropalladate(II) at low and ambient temperatures","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","375","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527732","7.0134","","7.0134","","12.92","","90","","90","","120","","550.364","","","","","","","","","","","","","5","P 31 2 1","P 31 2""","152","","Ce Na (S O4)2 (H2 O)","","- Ce H2 Na O9 S2 -","- Ce Na O9 S2 -","- Ce3 Na3 O27 S6 -","3","0.5","","Lindgren, O.","The crystal structure of sodium cerium(III) sulfate hydrate, Na Ce (S O4)2 (H2 O)","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","591","594","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527881","4.732","","6.037","","5.204","","90","","90","","90","","148.663","","","","","","","","","","","","","2","P b c n","-P 2n 2ab","60","","Mo2 C","","- C Mo2 -","- C1.02 Mo2 -","- C4.08 Mo8 -","4","0.5","","Norlund Christensen, A.","A neutron diffraction investigation on a crystal of alpha-Mo2 C","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","509","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528096","9.231","","9.231","","9.231","","90","","90","","90","","786.586","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","(N H4)3 (Ti F6.98)","","- F6.98 H12 N3 Ti -","- F6.984 H12.002 N3 Ti -","- F27.936 H48.008 N12 Ti4 -","4","0.0208333","","Stomberg, R.; Svensson, I.B.","The disordered structure of ammonium pentafluoroperoxotitanate(IV), (N H4)3 (Ti F5 (O2))","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","635","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529103","9.4128","","9.4128","","3.3361","","90","","90","","90","","295.581","","","","","","","","","","","","","2","P 4/m","-P 4","83","","V3 As2","","- As2 V3 -","- As2 V3 -","- As8 V12 -","4","0.5","","Berger, R.","The crystal structure of V3 As2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","287","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","152166","2020-10-21","18:00:00",""
"1533704","7.8304","","7.8304","","7.8361","","90","","90","","120","","416.101","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Co3 W10 C3.4","","- C3.4 Co3 W10 -","- C3.415 Co3 W10 -","- C6.83 Co6 W20 -","2","0.0833333","","Harsta, A.; Rundqvist, S.; Johansson, T.; Thomas, J.O.","A neutron powder diffraction study of the kappa-phase in the Co-W-C system","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","260","264","","","","","","","","","","","","","","","","","","","","","","has coordinates","159973","2020-10-21","18:00:00",""
"1533747","9.5031","","9.5031","","4.8255","","90","","90","","90","","435.786","","","","","","","","","","","","","2","I 4/m c m","-I 4 2c","140","","V5 As2.74","","- As2.74 V5 -","- As2.743 V5 -","- As10.972 V20 -","4","0.125","","Berger, R.","Crystal structure refinement of alpha-V5 As3","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","223","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","160018","2020-10-21","18:00:00",""
"1534049","15.583","","13.448","","6.748","","90","","90","","95.39","","1407.86","","","","","","","","","","","","","4","A 1 1 2/a","-A 2a","15","","Ce2 (O H)2 (S O4)3 (H2 O)4","","- Ce2 H10 O18 S3 -","- Ce2 O18 S3 -","- Ce8 O72 S12 -","4","0.5","","Lindgren, O.","The crystal structure of a dimeric cerium(IV) sulfate, Ce2 (O H)2 (S O4)3 (H2 O)4","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","163","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534050","6.5865","","10.6716","","5.6699","","90","","92.59","","90","","398.122","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Ce (Cr O4)2 (H2 O)2","","- Ce Cr2 H4 O10 -","- Ce Cr2 O10 -","- Ce2 Cr4 O20 -","2","0.5","","Lindgren, O.","The crystal structure of cerium(IV) dichromate dihydrate, Ce (Cr O4)2 (H2 O)2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","167","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534062","9.866","","11.502","","9.152","","90","","98.3","","90","","1027.68","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na4 (Cr (C N)6) (H2 O)10","","- C6 H20 Cr N6 Na4 O10 -","- C6 Cr N6 Na4 O10 -","- C12 Cr2 N12 Na8 O20 -","2","0.5","","Ljungstroem, E.","The crystal structure of sodium hexacyanochromate(II) decahydrate, Na4 (Cr (C N)6) (H2 O)10","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","104","108","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9009911","5.9718","","3.8621","","6.3242","","90","","90","","90","","145.859","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Rh Sb -","- Rh Sb -","- Rh4 Sb4 -","4","0.5","","Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F.","On the MnP type structure of RuSb and RhSb","Acta Chemica Scandinavica A","1977","31","","249","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009912","5.9608","","3.7023","","6.5797","","90","","90","","90","","145.205","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Ru Sb -","- Ru Sb -","- Ru4 Sb4 -","4","0.5","","Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F.","On the MnP type structure of RuSb and RhSb","Acta Chemica Scandinavica A","1977","31","","249","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009913","5.1169","","5.8915","","2.8709","","90","","90","","90","","86.547","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- P2 Ru -","- P2 Ru -","- P4 Ru2 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009914","5.4279","","6.1834","","2.9685","","90","","90","","90","","99.631","","","","","","","","","","","","Synthetic","2","P n n m","-P 2 2n","58","","","Anduoite","- As2 Ru -","- As2 Ru -","- As4 Ru2 -","2","0.25","","RuAs2; Kjekshus A; Rakke T; Andresen A F","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009915","5.9514","","6.6743","","3.179","","90","","90","","90","","126.274","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Ru Sb2 -","- Ru Sb2 -","- Ru2 Sb4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009916","5.1012","","5.9022","","2.9183","","90","","90","","90","","87.865","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Os P2 -","- Os P2 -","- Os2 P4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009917","5.4115","","6.19","","3.0127","","90","","90","","90","","100.917","","","","","","","","","","","","Synthetic","2","P n n m","-P 2 2n","58","","","Omeiite","- As2 Os -","- As2 Os -","- As4 Os2 -","2","0.25","","OsAs2; Kjekshus A; Rakke T; Andresen A F","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009918","5.9411","","6.6873","","3.2109","","90","","90","","90","","127.569","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Os Sb2 -","- Os Sb2 -","- Os2 Sb4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9012563","16.756","","3.6391","","8.023","","90","","111.18","","90","","456.17","","","","","","","","","","","","Synthetic","4","P 1 21/a 1","-P 2yab","14","","","Munirite","- H3.78 Na O4.89 V -","- H2.89 Na O4.89 V -","- H11.56 Na4 O19.56 V4 -","4","1","","Bjornberg, A.; Hedman, B.","The crystal structure of NaVO3*1.89H2O Note: one of the H atoms could not be found","Acta Chemica Scandinavica A","1977","31","","579","584","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""