Preparation, characterization, and structure of alpha-zirconium hydrogen phosphate hemihydrate,
G. Alberti, U. Costantino, R. Millini, G. Perego & R. Vivani,
J. Solid State Chem. 113 (1994) 289-295.
alpha-Zr(HPO4)2.0.5H2O, C2/c, C1=7, Nc=16, C2=2, XC12 /
TREOR, FIT, PART, ? (PATT), ?, PREFIN
alpha-Zr(HPO4)2.0.5H2O, R-3, C1=5, Nc=5, C2=G, XC12 /
..........GUESSED........., PREFIN

The structure of Li0.43Na0.36CoO1.96 using neutron powder diffraction,
R.J. Balsys & R.L. Davis,
Solid State Ionics 69 (1994) 69-74.
Li0.43Na0.36CoO1.96, P63mc, C1=9, Nc=6, C2=4, N /
?, ?, ?, SHELXS (DM), ?, ?

U(UO2)(PO4)2, a new mixed-valence uranium orthophosphate: ab initio structure determination from powder diffraction data and optical and X-ray photoelectron spectra,
P. Benard, D. Louer, N. Dacheux, V. Brandel & M. Genet,
Chem. Mater. 6 (1994) 1049-1058 ;See also : M. Genet, P. Benard & D. Louër, Materials Sci. Forum 166/169 (1994) 625.
U(UO2)(PO4)2, P-1, C1=14, Nc=42, C2=2, XC1+N /
DICVOL91, FULLP, EQUI, Mol (PATT), Mol+FULLP, FULLP

Structure of MoO3.1/2H2O by conventional X-ray powder diffraction,
P. Benard, L. Seguin, D. Louer & M. Figlarz,
J. Solid State Chem.108 (1994) 170-176.
MoO3.1/2H2O, P21/m, C1=9, Nc=18, C2=2, XC1 /
DICVOL91, FULLP, EQUI, Mol (PATT), Mol+FULLP, FULLP

An examination of the structures of iodosylbenzene (PhIO) and the related imido compound, PhINSO2-4-Me-C6H4, by X-ray powder diffraction and EXAFS (extendex X-ray absorption fine structure) spectroscopy,
C.J. Carmalt, J.G. Crossley, J.G. Knight, P. Lightfoot, A. Martin, M.P. Muldowney, N.C. Norman & G. Orpen,
J. Chem. Soc., Chem. Commun., (1994) 2367-2368.
C13H12INO2S, P21/c, C1= Nc= C2=1 XC1 /
TREOR, GSAS, EQUI, SIR88 (DM), GSAS, GSAS

Crystal structure of Bi2CdO4,
J.-C. Champarnaud-Mesjard, B. Frit, A. Aftati & M. El Farissi,
Eur. J. Solid State Inorg. Chem. 31 (1994) 473-486.
Bi2CdO4, I41/amd, C1=6, Nc=12, C2=3, XC12 /
DICVOL, FULLP, EQUI, SHELXS (DM), ?+FULLP, FULLP

A crystal structure determination of HgC2O4 from synchrotron X-ray and neutron powder diffraction data,
A.N. Christensen, P. Norby & J.C. Hanson,
Z. Kristallogr. 209 (1994) 874-877.
HgC2O4, P21, C1=7, Nc=20, C2=1;3 Sync+N /
ITO+TREOR+DICVOL91, ALLHKL, EQUI, SIRPOW92 (DM), ?, DBW3.2S

Structure of solid trichlorofluoromethane, CFCl3, by powder neutron diffraction,
J.K. Cockcroft & A.N. Fitch,
Z. Kristallogr. 209 (1994) 488-490.
CFCl3, Pbca, C1=5, Nc=15, C3=1, N /
FZON, ALHKL, EQUI, NORESULT, MM(rot + trans. of CFCl3), PROFIL

Synthesis and crystal structure determination of TlAg3S2,
L. Eriksson & T. Elfwing,
Materials Science Forum 166-169 (1994) 683-686.
TlAg3S2, Pbcn, C1=4, Nc=8, C2=3, XC1 /
TREOR, FIT (STOE), PART, SHELXS (PATT), ?, DBW

Li3Ni2TaO6 - A novel rock salt superstructure phase with partial cation order
J.G. Fletcher, G.C. Mather, A.R. West, M. Castellanos & M.P. Gutierrez,
J. Mater. Chem. 4 (1994) 1303-1305
Li3Ni2TaO6, Fddd, C1=6, Nc=6, C2=MB, XC1 /
KNOWN, ... MB by THEO ..., ?
and see also : Synthesis and structures of the partially ordered rock salt phases, Li3M2XO6 : M = Mg, Co, Ni ; X = Nb, Ta, Sb,
G.C. Mather, R.I. Smith, J.M.S. Skakle, J.G. Fletcher, M.A. Castellanos, M.P. Gutierrez & A.R. West,
J. Mater. Chem. 5 (1995) 1177-1182.

Ab initio structure determination of Zr(OH)2SO4.3H2O using conventional X-ray powder diffraction,
D. Gascoigne, S.E. Tarling, P. Barnes, C.F. Pygall, P. Benard & D. Louer,
J. Appl. Cryst. 27 (1994) 399-405.
Zr(OH)2SO4.3H2O, P21/c, C1=11, Nc=33, C2=2, XC1 /
DICVOL91, FULLP, EQUI, Mol (PATT), Mol+FULLP, FULLP

Monoclinic Sr2Mg3H10 with Ba2Ni3F10-type structure,
F. Gingl, K. Yvon and P. Fisher,
J. Alloys Compounds 206 (1994) 73-75.
Sr2Mg3H10, C2/m, C1=13, Nc=24, C2=5, XC1+N /
DICVOL91, ?, ?, SHELXS (DM), DBW+ANALOG, DBWS

The crystal structure of the low-temperature A-type modification of Pr2O3 from X-ray powder and electron single crystal diffraction,
O. Greis, R. Ziel, B. Breidenstein, A. Haase & T. Petzel,
J. Alloys & Compounds 216 (1994) 255-258.
A-Pr2O3, P-3m1, C1=3, Nc=2, C2= , XC1 /
ED, SPECTRA-2, ..., POWLS-80

Crystal structure solution of LuAu1+xGa2-x from X-ray powder diffraction data,
Yu. Grin & B. Baumgartner,
Materials Science Forum 166-169 (1994) 473-478.
LuAu1+xGa2-x, Cmcm, C1=3, Nc=7, C2=2, XC1 /
All with the CSD package (PATT)

An X-ray and neutron powder diffraction study of a new polymorphic phase of copper hydroxide nitrate,
N. Guillou, M. Louer & D. Louer,
J. Solid State chem. 109 (1994) 307-314.
Cu2(OH)3(NO3), P21, C1=12, Nc=35, C2=2, XC1+N /
DICVOL91, FULLP, PART, ? (DM), WYRIET+?, FULLP

Hydrothermal synthesis of a new molybdate with a layered structure, (NMe4)Mo4O12,
J.-D. Guo, P. Zavalij & M.S. Whittingham,
Chem. Mater. 6(4) (1994) 357-359.
[N(CH3)4]Mo4O12, C2/c, C1=13, Nc=25, C2=5, XC12/
All with the CSD package, DBW6-9006PC for 2nd phase

Crystal structure determination from powder diffraction data by Monte Carlo methods,
K.D.M Harris, M. Tremayne, P. Lightfoot & P.G. Bruce,
J. Am. Chem. Soc. 116 (1994) 3543-3547.
p-BrC6H4CH2CO2H, P21/n, C1=17, Nc=51, C2=1, XC1 /
ITO, ........ MC ........., ?+?, ?

Determination of the structure of beta-CuI by high-resolution neutron powder diffraction,
D.A. Keen & S. Hull,
J. Phys. : Condens. Matter 6 (1994) 1637-1644.
beta-CuI, P-3m1, C1=3, Nc=3, MB, N /
?, .... MB ...., TF12LS

The crystal structure of SrCl2 and BaCl2 hemihydrates by powder diffraction,
W. Lasocha & M. Michalec,
Cryst. Res. Technol. 29 (1994) 1085-1090.
SrCl2, Pmmm, C1=7, Nc=11, C2=4, XC1 /
ITO, KNOWN, PART, SHELXS-86 (PATT), XRS82, DBW

Application of a new method for the determination of accurate intensities from powder diffraction data. Crystal structure determination of fibrillar silver trimolybdate,
W. lasocha, J. Jansen & H. Schenk,
J. Solid State Chem. 109 (1994) 1-4.
Ag2O.3MoO3.1.8H2O, Pnma, C1=12, Nc=26, C2=4, XC12 /
?, LSQPROF, PART+DOREES, SIMPEL88+SHELXS (DM+PATT), XTAL+XRS-82, XRS-82

Bi7F11O5: a new ordered anion-excess fluorite-related structure with columnar clustars,
J.-P. Laval, J.-C. Champarnaud-Mesjard, B. Frit, A. Britel & A. Mikou,
Eur. J. Solid State Inorg. Chem. 31 (1994) 943-956.
Bi7F11O5, C2, C1=13, Nc=32, C2=4, XX12 /
DICVOL, FULLP, EQUI, SHELXS (DM), SHELXL-93+FULLP, FULLP

Crystal structures of the polymer electrolytes poly(ethylene oxide)4 : MSCN (M = NH4, K),
P. Lightfoot, J.L. Nowinski & P.G. Bruce,
J. Am. Chem. Soc. 116 (1994) 7469-7470.
PeO4 : NH4SCN, C2/c, C1=16, Nc=48, C2=1, XC1 /
KNOWN, GSAS, EQUI, SIR88 (DM), GSAS, GSAS

Ab initio determination of crystal structures by X-ray powder diffraction: structure of Li29Zr9Nb3O40,
P. Lightfoot, J. B. Thomson, F.J. Little & P.G. Bruce,
J. Mater. Chem. 4 (1994) 167-169.
Li29Zr9Nb3O40, Immm, C1=16, Nc=20, C2=3, XC1 /
ITO, GSAS, EQUI, SHELXS (DM), GSAS, GSAS

Ab initio crystal structure determination of VO(H2PO2)2.H2O from X-ray and neutron powder diffraction data. A monodimensional vanadium (IV) hypophosphite,
A. Le Bail, M.D. Marcos & P. Amoros,
Inorg. Chem. 33 (1994) 2607-2613.
VO(H2PO2)2.H2O, C2/c, C1=9, Nc=21, C2=4, XC12+N /
TREOR, ARITB, EQUI, SHELXS (DM), SHELX-76+ARIT1, ARIT1

Structural characterization of pyridazine (pydz) adducts of MX2 (M = Mn, Fe, Co, Ni, Cu or Zn ; X = Cl or Br). Ab-initio X-ray powder diffraction determination of polymeric [NiX2(Pydz)] complexes,
N. Masciocchi, P. Cairati, L. Carlucci, G. Ciani, G. Mezza, N. Sironi,
J. Chem. Soc. 20 (1994) 3009-3018.
[NiX2(Pydz)], Imma, C1=5, Nc=8, C2=3, XC12 /
TREOR, ALLHKL, EQUI, SIRPOW (DM), DBW+?, GSAS

The multiphase nature of the Cu(pz) and Ag(pz) (Hpz=pyrazole) systems: selective syntheses and ab-initio X-ray powder diffraction structural characterization of copper(i) and silver(i) pyrazolates,
N. Masciocchi, M. Moret, P. Cairati, A. Sironi, G.A. Ardizzoia & G. LaMonica,
J. Amer. Chem. Soc. 116 (1994) 7668-7677.
C3H3AgN2, Pbca, C1= , Nc, C2=MM, XC12 /
TREOR, WPPF, PART, P-RISCON (MB), DBW3.2+?, GSAS
C9H9Ag6N6, Pbcn, C1= , Nc, C2=2, XC12 /
TREOR, ALLHKL, EQUI, SIRPOW (DM), ?+?, GSAS

Determination of complex structures from powder diffraction data: the crystal structure of La3Ti5Al15O37,
R.E. Morris, J.J. Owen, J.K. Stalick & A.K. Cheetham,
J. Solid State Chem. 111 (1994) 52-57.
La3Ti5Al15O37, Cc, C1=60, Nc=178, C2=5, Sync+N /
?, GSAS, EQUI, MULTAN84 (DM), GSAS, GSAS

Powder diffraction studies in the YONO3-Y2O3 system,
D. Pelloquin, M. Louer & D. Louer,
J. Solid State Chem. 112 (1994) 182-188.
YONO3, P4/nmm, C1=5, Nc=5, C2=3, XC1 /
DICVOL91, FULLP, EQUI, Mol-MULTAN (DM), Mol, FULLP

Synthesis, characterization, and ab initio structure determination from powder diffraction data of a new X' form of anhydrous copper(II) 8-hydroxyquinolate doped with amine. Modeling of the polymorphic transformation to the stable anhydrous beta'' form,
S. Petit, G. Coquerel, G. Perez, D. Louer & M. Louer,
Chem. Mater. 6 (1994) 116-121.
C18H12O2N2Cu, P21/c, C1=12, Nc=36, C3=1, XC1 /
DICVOL91, FULLP, EQUI, PATSEE (MB), PATSEE, FULLP

The novel thiogermanate [(CH3)4N]4Ge4S10 with a high cubic cell volume. Ab initio structure determination from conventional X-ray powder diffraction,
J.Y. Pivan, O. Achak, M. Louer & D. Louer,
Chemistry of Materials 6 (1994) 827.
[(CH3)4N]4Ge4S10, P-43n, C1=15, Nc=33, C2=8, XC1 /
DICVOL91, FULLP, EQUI, SHELXS (DM), FULLP+?, FULLP

Crystal structure of silicon pyrophosphate (form I) from powder diffraction data,
D.M. Poojary, R.B. Borade, F.L. Campbell III & A. Clearfield,
J. Solid State Chem. 112 (1994) 106-112.
SiP2O7-I, P63, C1=6, Nc=9, C2=3, XC12 /
TREOR, ?, PART, SHELXS-86 (PATT), TEXSAN, GSAS

Crystal structure of sodium zirconium phosphate, Zr2(NaPO4)4.6H2O, from X-ray powder diffraction data,
D.M. Poojary, A. Clearfield,
Inorg. Chem. 33 (1994) 3685-3688.
Zr2(NaPO4)4.6H2O, P1, C1=32, Nc=93, C2=10, XC12 /
ITO, MLE, PART, TEXAN-MITHRIL (DM+PATT), GUESSED, GSAS

Synthesis, crystal structures, and ion-exchange properties of a novel porous titanosilicate,
D.M. Poojary, R.A. Cahill & A. Clearfield,
Chem. Mater. 6 (1994) 2364-2368.
Na2Ti2O3SiO4.2H2O, P42/mcm, C1=9, Nc=13, C2=1, XC12 /
ITO, MLE, PART, TEXSAN (PATT), TEXSAN, GSAS
124C)- E.B. Sokolova, R.K. Rastsvetaeva, V.I. Andrianov, Yu. K. Egorov-Tismenko and Yu.P. Men'shikov,
Sov. Phys. Dokl. 1989, 34, 114.

Structure of a novel layered zirconium diphosphonate compound, Zr2(O3PCH2CH2-viologen -CH2CH2PO3) F6.2H2O,
D.M. Poojary, L.A. Vermeulen, E. Vicenzi, A. Clearfield & M.E. Thompson,
Chem. Mater. 6 (1994) 1845-1849.
Zr2(O3PCH2CH2-viologen -CH2CH2PO3) F6.2H2O, P21/c, C1=17, Nc=51, C2=2, XC12 /
ITO + TREOR, MLE, PART, TEXSAN (PATT) + MITHRIL (DM), TEXSAN, GSAS

Structure of a mixed phosphate/phosphonate layered zirconium compound from synchrotron X-ray powder diffraction data,
D.M. Poojary, B. Zhang & A. Clearfield,
Angew. Chem., Int. Ed. Engl. 33 (1994) 2324-2326.
C10H19N2O20P3Zr2, P21/c, C1=19, Nc=55, C2=3, XC12+Sync /
ITO, PD, PART, ? (PATT), GSAS, GSAS

Synthesis and crystal structure of a new layered zirconium phosphate compound, Zr(PO4)F(OSMe2),
D.M. Poojary, B. Zhang & A. Clearfield,
J. Chem. Soc. Dalton Trans. (1994) 2453-2456.
Zr(PO4)F(OSMe2), P4/n, C1=7, Nc=10, C2=2, XC12 /
ITO, MLE, PART, TEXSAN(PATT), GSAS, GSAS

Synthesis and crystal structures of aluminum and iron phosphites,
D.M. Poojary, Y. Zhang, D.E. Cox, P.R. Rudolf, S. Cheng & A. Clearfield,
J. Chem. Crystallogr. 24 (1994) 155-163.
Al2(HPO3)3.4H2O, P21, C1=18, Nc=53, C2=7, Sync/
TREOR, ?, PART, TEXSAN (DM), GSAS, GSAS
R.E. Morris, W.T.A. Harrison, J.M. Nicol, A.P. Wilkinson & A.K. Cheetham, Nature 359 (1992) 519-522.

X-ray powder structure of monoammonium-exchanged phase of gamma-zirconium phoaphate Zr(PO4)(NH4HPO4),
D.M. Poojary, B. Zhang, Y. Dong, G. Peng & A. Clearfield,
J. Phys. Chem. 98 (1994) 13616-13620.
Zr(PO4)(NH4HPO4), P21/m, C1=10, Nc=22, C2=2, XC12 /
ITO, MLE, PART,? (PATT), GSAS, GSAS

Nickel oxide interstratified a-zirconium phosphate, a composite exhibiting ferromagnetic behavior,
B. Shpeizer, D.M. Poojary, K. Ahn, C. Runyan & A. Clearfield,
Science 266 (1994) 1357-1359.

Crystal and molecular structures of rhenium heptafluoride,
T. Vogt, A.N. Fitch & J.K. Cockcroft,
Science 263 (1994) 1265-1267.
ReF7, C-1, C1=8, Nc=24, C2=5, N /
FZON, PAWHKL, EQUI, SHELXS (DM), PROFIL+?, PROFIL

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Armel Le Bail