Sergevanite, Na15(Ca3Mn3)(Na2Fe)Zr3Si26O72(OH)3·H2O, a new eudialyte-group mineral from the Lovozero alkaline massif, Kola Peninsula

2020 ◽  
Vol 58 (4) ◽  
pp. 421-436 ◽  
Author(s):  
Nikita V. Chukanov ◽  
Sergey M. Aksenov ◽  
Igor V. Pekov ◽  
Dmitriy I. Belakovskiy ◽  
Svetlana A. Vozchikova ◽  
...  

ABSTRACT The new eudialyte-group mineral sergevanite, ideally Na15(Ca3Mn3)(Na2Fe)Zr3Si26O72(OH)3·H2O, was discovered in highly agpaitic foyaite from the Karnasurt Mountain, Lovozero alkaline massif, Kola Peninsula, Russia. The associated minerals are microcline, albite, nepheline, arfvedsonite, aegirine, lamprophyllite, fluorapatite, steenstrupine-(Ce), ilmenite, and sphalerite. Sergevanite forms yellow to orange-yellow anhedral grains up to 1.5 mm across and the outer zones of some grains of associated eudialyte. Its luster is vitreous, and the streak is white. No cleavage is observed. The Mohs' hardness is 5. Density measured by equilibration in heavy liquids is 2.90(1) g/cm3. Calculated density is equal to 2.906 g/cm3. Sergevanite is nonpleochroic, optically uniaxial, positive, with ω = 1.604(2) and ε = 1.607(2) (λ = 589 nm). The infrared spectrum is given. The chemical composition of sergevanite is (wt.%; electron microprobe, H2O determined by HCN analysis): Na2O 13.69, K2O 1.40, CaO 7.66, La2O3 0.90, Ce2O3 1.41, Pr2O3 0.33, Nd2O3 0.64, Sm2O3 0.14, MnO 4.15, FeO 1.34, TiO2 1.19, ZrO2 10.67, HfO2 0.29, Nb2O5 1.63, SiO2 49.61, SO3 0.77, Cl 0.23, H2O 4.22, –O=Cl –0.05, total 100.22. The empirical formula (based on 25.5 Si atoms pfu, in accordance with structural data) is H14.46Na13.64K0.92Ca4.22Ce0.27La0.17Nd0.12Pr0.06Sm0.02Mn1.81Fe2+0.58Ti0.46Zr2.67Hf0.04Nb0.38Si25.5S0.30Cl0.20O81.35. The crystal structure was determined using single-crystal X-ray diffraction data. The new mineral is trigonal, space group R3, with a = 14.2179(1) Å, c = 30.3492(3) Å, V = 5313.11(7) Å3, and Z = 3. In the structure of sergevanite, Ca and Mn are ordered in the six-membered ring of octahedra (at the sites M11 and M12), and Na dominates over Fe2+ at the M2 site. The strongest lines of the powder X-ray diffraction pattern [d, Å (I, %) (hkl)] are: 7.12 (70) (110), 5.711 (43) (202), 4.321 (72) (205), 3.806 (39) (033), 3.551 (39) (220, 027), 3.398 (39) (313), 2.978 (95) (), 2.855 (100) (404). Sergevanite is named after the Sergevan' River, which is near the discovery locality.

2021 ◽  
pp. 1-8
Author(s):  
Jiří Sejkora ◽  
Pavel Škácha ◽  
Jakub Plášil ◽  
Zdeněk Dolníček ◽  
Jana Ulmanová

Abstract The new mineral hrabákite (IMA2020-034) was found in siderite–sphalerite gangue with minor dolomite–ankerite at the dump of shaft No. 9, one of the mines in the abandoned Příbram uranium and base-metal district, central Bohemia, Czech Republic. Hrabákite is associated with Pb-rich tučekite, Hg-rich silver, stephanite, nickeline, millerite, gersdorffite, sphalerite and galena. The new mineral occurs as rare prismatic crystals up to 120 μm in size and allotriomorphic grains. Hrabákite is grey with a brownish tint. Mohs hardness is ca. 5–6; the calculated density is 6.37 g.cm–3. In reflected light, hrabákite is grey with a brown hue. Bireflectance is weak and pleochroism was not observed. Anisotropy under crossed polars is very weak (brownish tints) to absent. Internal reflections were not observed. Reflectance values of hrabákite in air (Rmin–Rmax, %) are: 39.6–42.5 at 470 nm, 45.0–47.5 at 546 nm, 46.9–49.2 at 589 nm and 48.9–51.2 at 650 nm). The empirical formula for hrabákite, based on electron-microprobe analyses (n = 11), is (Ni8.91Co0.09Fe0.03)9.03(Pb0.94Hg0.04)0.98(Sb0.91As0.08)0.99S7.99. The ideal formula is Ni9PbSbS8, which requires Ni 47.44, Pb 18.60, Sb 10.93 and S 23.03, total of 100.00 wt.%. Hrabákite is tetragonal, P4/mmm, a = 7.3085(4), c = 5.3969(3) Å, with V = 288.27(3) Å3 and Z = 1. The strongest reflections of the calculated powder X-ray diffraction pattern [d, Å (I)(hkl)] are: 3.6543(57)(200); 3.2685(68)(210); 2.7957(100)(211); 2.3920(87)(112); 2.3112(78)(310); 1.8663(74)(222); and 1.8083(71)(302). According to the single-crystal X-ray diffraction data (Rint = 0.0218), the unit cell of hrabákite is undoubtedly similar to the cell reported for tučekite. The structure contains four metal cation sites, two Sb (Sb1 dominated by Pb2+) and two Ni (with minor Co2+ content) sites. The close similarity in metrics between hrabákite and tučekite is due to similar bond lengths of Pb–S and Sb–S pairs. Hrabákite is named after Josef Hrabák, the former professor of the Příbram Mining College.


2015 ◽  
Vol 79 (3) ◽  
pp. 583-596 ◽  
Author(s):  
E. V. Sokol ◽  
Y. V. Seryotkin ◽  
S. N. Kokh ◽  
Ye. Vapnik ◽  
E. N. Nigmatulina ◽  
...  

AbstractFlamite (Ca,Na,K)2(Si,P)O4 (P63; a = 43.3726(18), c = 6.8270(4) Å; V = 11122.2(9) Å3), a natural analogue of the P,Na,K-doped high-temperature α-Ca2SiO4 modification, is a new mineral from Ca- and Al-rich paralava, an ultrahigh-temperature combustion metamorphic melt rock. The type locality is situated in the southern Hatrurim Basin, the Negev Desert, Israel. Flamite occurs as regular lamellar intergrowths with partially hydrated larnite, together with rock-forming gehlenite, rankinite and Ti-rich andradite, minor ferrian perovskite, magnesioferrite, hematite, and retrograde ettringite and calcium silicate hydrates. The mineral is greyish to yellowish, transparent with a vitreous lustre, non-fluorescent under ultraviolet light and shows no parting or cleavage; Mohs hardness is 5–5½; calculated density is 3.264 g cm–3. The empirical formula of holotype flamite (mean of 21 analyses) is (Ca1.82Na0.09K0.06(Mg,Fe,Sr,Ba)0.02)Σ1.99(Si0.82P0.18)Σ1.00O4. The strongest lines in the powder X-ray diffraction pattern are [d, Å (Iobs)]: 2.713(100), 2.765(44), 2.759(42), 1.762(32), 2.518(29), 2.402(23), 2.897(19), 1.967(18), 2.220(15), 1.813(15). The strongest bands in the Raman spectrum are 170, 260, 520, 538, 850, 863, 885, 952 and 1003 cm–1.


2015 ◽  
Vol 79 (3) ◽  
pp. 661-669 ◽  
Author(s):  
A. R. Kampf ◽  
P. M. Adams ◽  
B. P. Nash ◽  
J. Marty

AbstractFerribushmakinite (IMA2014-055), Pb2Fe3+(PO4)(VO4)(OH), the Fe3+ analogue of bushmakinite, is a new mineral from the Silver Coin mine, Valmy, Iron Point district, Humboldt County, Nevada, USA, where it occurs as a low-temperature secondary mineral in association with plumbogummite, mottramite, Br-rich chlorargyrite and baryte on massive quartz. Ferribushmakinite forms yellow slightly flattened prisms up to 0.2 mm long growing in X and sixling twins. The streak is pale yellow. Crystals are translucent and have adamantine lustre. The Mohs hardness is ∼2, the tenacity is brittle, the fracture is irregular to splintery and crystals exhibit one or two fair cleavages in the [010] zone. The calculated density is 6.154 g/cm3. Electron microprobe analyses provided: PbO 63.69, CaO 0.07, CuO 1.11, Fe2O3 7.63, Al2O3 1.63, V2O5 12.65, As2O5 3.09, P2O58.63, H2O 1.50 (structure), total 100.00 wt.% (normalized). The empirical formula (based on nine O a.p.f.u.) is: (Pb1.99Ca0.01)Σ2.00(Fe0.66Al0.22Cu0.10)Σ0.98(V0.97P0.85As0.19)Σ2.01O7.84(OH)1.16. Ferribushmakinite is monoclinic, P21/m, a = 7.7719(10), b = 5.9060(7), c = 8.7929(12) Å, β = 111.604(8)°, V = 375.24(9) Å3 and Z = 2. The eight strongest lines in the powder X-ray diffraction pattern are [dobs in Å (I)(hkl)]: 4.794(46)(011); 3.245(84)(211); 2.947(100)(020,212,103); 2.743(49)(112); 2.288(30)(220); 1.8532(27)(314,403); 1.8084(27)(multiple); and 1.7204(28)(312,114,321). Ferribushmakinite is a member of the brackebuschite supergroup. Its structure (R1 = 3.83% for 577 Fo > 4σF) differs from that of bushmakinite only in the dominance of Fe3+ over Al in the octahedral site.


2017 ◽  
Vol 81 (1) ◽  
pp. 113-122 ◽  
Author(s):  
Atali A. Agakhanov ◽  
Leonid A. Pautov ◽  
Elena Sokolova ◽  
Frank C. Hawthorne ◽  
Vladimir Yu Karpenko ◽  
...  

AbstractOdigitriaite, a new Cs, Na, Ca borosilicate mineral, was discovered in moraine adjacent to the Darai-Pioz alkaline massif in the upper reaches of the Darai-Pioz river at the intersection of the Turkestansky, Zeravshansky and Alaisky mountain ridges, Tajikistan. It occurs as irregular thin flakes associated with quartz, pectolite, baratovite, fluorite, pekovite, polylithionite, aegirine, leucosphenite, pyrochlore, neptunite, reedmergnerite, mendeleevite-(Ce), zeravshanite and sokolovaite. It is colourless with a white streak, is translucent and has a vitreous lustre; it does not fluoresce under ultraviolet light. Odigitriaite is brittle with an uneven fracture and a Mohs hardness of 5. The calculated density is 2.80(2) g/cm3. The indices of refraction are α = 1.502, β = 1.564, γ = 1.576; 2Vobs = 46(2)°, dispersion is weak r > v, and there is no pleochroism. The chemical composition is as follows (electron microprobe, H2O calculated from structure): SiO2 55.30, Al2O3 0.09, Y2O3 0.44, MnO 0.94, FeO 0.10, PbO 0.21, K2O 0.01 Cs2O 8.36, B2O3 4.75, H2O 0.37, F 1.74, O = F2 –0.74, total 99.43 wt.%. The empirical formula of odigitriaite is Cs0.90Na5.12Ca4.68Mn0.20Y0.06Fe0.02Pb0.01[Si13.92Al0.03B2.06O38]F1.39(OH)0.62. The end-member formula is CsNa5Ca5[Si14B2O38]F2. The strong reflections in the powder X-ray diffraction pattern are: [(d, Å), (I, %), (hkl)]: 5.45 (25) (1 1 3), 4.66 (33) (3 1 1), 4.40 (26) (0 2 2), 4.10 (36) (3 1 3), 3.95 (25) (3̄ 1 3), 2.85 (31) (2 2 2), 2.68 (40) (0 0 6), 3.62 (45) (0 2 4), 3.35 (100) (2̄ 2 4), 3.31 (30) (3̄ 1 5), 3.25 (35) (4 0 4), 3.04 (60) (4̄ 2 2), 2.925 (22) (4̄ 2 3), 1.813 (23) (9 1 0). Odigitriaite is monoclinic, space group C2/c, a = 16.652(5), b = 9.598 (3), c = 22.120(7) Å, β= 92.875(14)°, V = 3530.9(1.9) Å3, Z = 4. The crystal structure of odigitriaite was solved by direct methods and refined to an R1 value of 2.75% based on single-crystal X-ray data. It is a double-layer sheet-borosilicate mineral; Cs and Na are intercalated within the double-layer sheet, and the double layers are linked by interstitial Ca and Na atoms.


2016 ◽  
Vol 80 (7) ◽  
pp. 1265-1272 ◽  
Author(s):  
Anthony R. Kampf ◽  
Barbara P. Nash ◽  
Maurizio Dini ◽  
Arturo Molina A. Donoso

AbstractThe new mineral gajardoite (IMA2015-040), KCa0.5As3+4O6Cl2·5H2O, was found at the Torrecillas mine, Iquique Province, Chile, where it occurs as a secondary alteration phase in association with native arsenic, arsenolite,chongite, talmessite and torrecillasite. Gajardoite occurs as hexagonal plates up to ∼100 μm in diameter and 5 μm thick, in rosette-like subparallel intergrowths. Crystals are transparent, with vitreous lustre and white streak. The Mohs hardness is ∼1½, tenacity is brittleand fracture is irregular. Cleavage is perfect on {001}. The measured density is 2.64 g/cm3 and the calculated density is 2.676 g/cm3. Optically, gajardoite is uniaxial (–) with ω = 1.780(3) and ε = 1.570(5) (measured in white light). The mineral is very slowly soluble in H2O and slowly soluble in dilute HCl at room temperature. The empirical formula, determined from electron-microprobe analyses, is (K0.77Ca0.71Na0.05Mg0.05)∑1.58As4O11Cl1.96H9.62.Gajardoite is hexagonal, P6/mmm, a = 5.2558(8), c = 15.9666(18) Å, V = 381.96(13) Å3 and Z = 1. The eight strongest powder X-ray diffraction lines are [dobs Å(I)(hkl)]: 16.00(100)(001), 5.31(48)(003),3.466 (31)(103), 3.013(44)(104), 2.624(51)(006,110,111), 2.353(36)(113), 1.8647(21)(116,205) and 1.4605(17) (119,303,216). The structure, refined to R1 = 3.49% for 169 Fo > 4σF reflections, contains two types of layers. One layer of formulaKAs3+4O6Cl2 consists of two neutral As2O3 sheets, between which are K+ cations and on the outside of which are Cl– anions. This layer is topologically identical to a slice of the lucabindiite structureand similar to a slice of the torrecillasite structure. The second layer consists of an edge-sharing sheet of Ca(H2O)6 trigonal pyramids with isolated H2O groups centred in the hexagonal cavities in the sheet.


2017 ◽  
Vol 81 (1) ◽  
pp. 135-141 ◽  
Author(s):  
Atali A. Agakhanov ◽  
Leonid A. Pautov ◽  
Elena Sokolova ◽  
Frank C. Hawthorne ◽  
Vladimir Yu Karpenko ◽  
...  

AbstractMendeleevite-(Nd), (Cs,□)6(□,Cs)6(□,K)6(REE,Ca)30(Si70O175)(OH,H2O,F)35 is a new mineral from the Darai-Pioz alkaline massif, Tajikistan. Mendeleevite-(Nd) was found in a pectolite aggregate in silexites (quartz-rich rocks) which consist of fine to medium pectolite grains, quartz, aegirine and fluorite, with minor khvorovite, mendeleevite-(Ce), sokolovaite, hyalotekite, orlovite, kirchhoffite, pekovite, neptunite, zeravshanite, senkevichite, nordite-(Nd), alamosite, pyrochlore-group minerals and baratovite. Mendeleevite-(Nd) forms colourless cubic crystals 10–40 μm in size; it has a vitreous lustre and a Mohs hardness of 5–5.5; Dmeas. = 3.20(2) g/cm3, Dcalc. = 3.155 g/cm3. Mendeleevite-(Nd) is optically isotropic, with the refractive index n = 1.582(2). Mendeleevite-(Nd) is cubic, space group Pm3̄, a = 21.9106(4) Å; Z = 2. The six strongest reflections in the powder X-ray diffraction pattern are [d (Å), I (%), (h k l)] are: 11.01, 100, (0 0 2); 15.63, 55, (0 1 1); 3.47, 42, (2 0 6); 3.099, 42, (3 4 5); 2.192, 42, (0 0 10); 1.819, 41, (3 6 10). Chemical analysis by electron microprobe gave SiO2 42.30, Ce2O3 10.12, La2O3 3.60, Nd2O3 16.19, Pr2O3 2.79, Sm2O3 4.19, Gd2O3 1.69, Eu2O3 0.47, SrO 2.99, CaO 2.20, Cs2O 8.50, K2O 0.85, H2O 3.85, F 1.25, –O = F2 –0.53, sum 100.46 wt.%, with H2O calculated by analogy with mendeleevite-(Ce). The empirical formula based on 210 (O + F) apfu, with F + OH + H2O = 35 pfu, is Cs6(□4.20K1.80)∑6{[(Nd9.57Ce6.13Sm2.39La2.20Pr1.68Gd0.93Eu0.27)∑23.17(Ca3.90Sr2.87)∑6.77]∑29.94□0.06}∑30(Si70.03O175)(OH14.47F6.54)∑21.01 (H2O)14, Z = 2. The simplified and ideal formulae are (Cs,□)6 (□,Cs)6(□,K)6 (REE,Ca)30 (Si70O175)(OH, H2O,F)35 and Cs6(REE23Ca7)(Si70O175)(OH,F)19(H2O)16, respectively. The compatibility index (from measured density) = – 0.039 (excellent). Mendeleevite-(Nd) is a Nd analogue of mendeleevite-(Ce), (Cs,□)6(□,Cs)6(□,K)6(REE,Ca,□)30(Si70O175)(H2O,OH,F,□)35. Both minerals are named after Dmitri Mendeleev (1834–1907), the great Russian chemist, author of the periodic table of chemical elements, who has had a significant impact on the development of natural sciences and industry, both in Russia and around the world.


2020 ◽  
Vol 9 ◽  
pp. 19-25
Author(s):  
R. K. Rastsvetaeva ◽  
◽  
N. V. Chukanov ◽  
Ch. Schäfer ◽  

Minerals of the eudialyte group from ultra-agpaitic associations are often characterized by high contents (up to the dominance) of sodium at the M2 site, which is populated with iron in eudialyte. The features of blocky isomorphism with the replacement of IVFe2+ by IVNa and VNa at the M2 micro-region are discussed. Using the methods of electron probe microanalysis, X-ray diffraction and IR spectroscopy, a potentially new mineral, M2Na-dominant analogue of eudialyte from the Ilimaussaq alkaline massif (Greenland), was investigated. Its crystal structure was refined to R = 5.6 % in the anisotropic approximation of atomic displacements using 1095 independent reflections with F > 3(F). The unit-cell parameters are: a = 14.208(1), c = 30.438(1) Å, V = 5321(1) Å3; the space group is R-3m. The idealized formula of the mineral is (Z = 3): (Na,H3O)15Ca6Zr3[Na2Fe][Si26O72](OH)2Cl∙2H2O.


2014 ◽  
Vol 78 (4) ◽  
pp. 787-795 ◽  
Author(s):  
A. R. Kampf ◽  
S. J. Mills ◽  
F. Hatert ◽  
B. P. Nash ◽  
M. Dini ◽  
...  

AbstractThe new mineral canutite (IMA2013-070), NaMn3[AsO4][AsO3(OH)]2, was found at two different locations at the Torrecillas mine, Salar Grande, Iquique Province, Chile, where it occurs as a secondary alteration phase in association with anhydrite, halite, lavendulan, magnesiokoritnigite, pyrite, quartz and scorodite. Canutite is reddish brown in colour. It forms as prisms elongated on [20] and exhibiting the forms {010}, {100}, {10}, {201} and {102}, or as tablets flattened on {102} and exhibiting the forms {102} and {110}. Crystals are transparent with a vitreous lustre. The mineral has a pale tan streak, Mohs hardness of 2½, brittle tenacity, splintery fracture and two perfect cleavages, on {010} and {101}. The calculated density is 4.112 g cm−3. Optically, canutite is biaxial (+) with α = 1.712(3), β = 1.725(3) and γ = 1.756(3) (measured in white light). The measured 2V is 65.6(4)°, the dispersion is r < v (slight), the optical orientation is Z = b; X ^ a = 18° in obtuse β and pleochroism is imperceptible. The mineral is slowly soluble in cold, dilute HCl. The empirical formula (for tabular crystals from near the mineshaft), determined from electron - microprobe analyses, is (Na1.05Mn2.64Mg0.34Cu0.14Co0.03)∑4.20As3O12H1.62. Canutite is monoclinic, C2/c, a = 12.3282(4), b = 12.6039(5), c = 6.8814(5) Å, β = 113.480(8)°, V = 980.72(10) Å3 and Z = 4. The eight strongest X-ray powder diffraction lines are [dobs Å(I)(hkl)]: 6.33(34)(020), 4.12(26)(21), 3.608(29)(310,31), 3.296(57)(12), 3.150(28)(002,131), 2.819(42)(400,041,330), 2.740(100)(240,02,112) and 1.5364(31)(multiple). The structure, refined to R1 = 2.33% for 1089 Fo > 4σF reflections, shows canutite to be isostructural with protonated members of the alluaudite group.


2015 ◽  
Vol 79 (7) ◽  
pp. 1769-1778 ◽  
Author(s):  
B. Rieck ◽  
H. Pristacz ◽  
G. Giester

AbstractA new silicate, colinowensite, BaCuSi2O6, has been found in the Wessels mine, Kalahari Manganese Field, South Africa. It is associated with effenbergerite, wesselsite, lavinskyite, scottyite, diegogattaite, as well as with pectolite, quartz, aegirine, richterite, minerals of the garnet group and a number of different manganese and iron oxides, especially hausmannite and hematite. The mineral was named for the mineral collector and finder of the new species, Colin R. Owens, of Somerset West, South Africa. Colinowensite is brittle, with uneven fracture, and the estimated Mohs hardness is ∼4. It occurs as subhedral crystals <100 μm in size. The forms {100} and {110} are observed while {001} is always present in cleavage plates. The calculated density is 4.236 g cm–3. It is the natural analogue of the synthetic pigmentreferred to as Chinese or Han purple, which is found on artifacts from ancient and imperial China. The mineral is of dark blue to purple colour, with a purple streak, and is uniaxial (–), with ω = 1.740 (20), ε = 1.735 (20) (420 nm) and ω = 1.745 (20), ε = 1.730(20) (650 nm). The lustre is vitreous and no fluorescence is observed under either shortwave or longwave ultraviolet radiation. Avery strong pleochroism occurs from purple along the c axis to blue in a perpendicular direction. Colinowensite is not soluble in acids except HF. Electron microprobe analyses gave an average composition (wt.%) of CuO 22.53, BaO 43.43 and SiO2 34.04 yielding the empirical formula (based on 6 O a.p.f.u.) BaCuSi2O6. The new mineral is tetragonal, space group I41/acd with Z = 16, anda = 9.967(1), c = 22.290 (2) Å. Colinowensite is a cyclosilicate with [Si4O12]8– 4-membered single rings, arranged in sheets parallel to (001). The structure is further characterized by CuO4 squares sharing corners with four neighbouring silicate rings within a sheet. Ba2+ cations are bonded to ten O atoms in irregular coordination. Average Si–O, Cu–O and Ba–O bond lengths are 1.619, 1.934 and 2.943 Å, respectively. Colinowensite belongs to subdivision 9. CE of the Strunz Mineralogical Tables. In addition, based on single-crystal X-ray work, new structural data for wesselsite of chemical composition Sr0.9Ba0.1CuSi4O10 are provided.


2019 ◽  
Vol 83 (4) ◽  
pp. 507-514
Author(s):  
Peter Elliott ◽  
Jakub Plášil ◽  
Václav Petříček ◽  
Jiří Čejka ◽  
Luca Bindi

ABSTRACTBaumoite, Ba0.5[(UO2)3O8Mo2(OH)3](H2O)~3, is a new mineral found near Radium Hill, South Australia, where it occurs in a granite matrix associated with baryte, metatorbernite, phurcalite and kaolinite. Baumoite forms thin crusts of yellow to orange–yellow tabular to prismatic crystals. The mineral is translucent with a vitreous lustre and pale yellow streak. Crystals are brittle, the fracture is uneven and show one excellent cleavage. The Mohs hardness is ~2½. The calculated density is 4.61 g/cm3. Optically, baumoite crystals are biaxial (–), with α = 1.716(4), β = 1.761(4), γ = 1.767(4) (white light); and 2Vcalc= 42.2°. Electron microprobe analyses gave the empirical formula Ba0.87Ca0.03Al0.04U2.97Mo2.02P0.03O22H11.99, based on 22 O atoms per formula unit. The eight strongest lines in the powder X-ray diffraction pattern are [dobsÅ (I) (hkl)]: 9.175(39)(12${\bar 1}$), 7.450(100)(020), 3.554(20)(221), 3.365(31)(004, 202), 3.255(31)(123, 30${\bar 2}$), 3.209(28)(12${\bar 4}$), 3.067(33)(30${\bar 3}$, 222, 32${\bar 2}$) and 2.977(20)(142). Single-crystal X-ray studies (R1= 5.85% for 1892 main reflections) indicate that baumoite is monoclinic, superspace groupX2/m(a0g)0swithX= (0,½,0,½), with unit-cell parameters:a= 9.8337(3),b= 15.0436(5),c= 14.2055(6) Å, β = 108.978(3)°,V= 1987.25(13) Å3andZ= 4. The crystal structure is twinned and incommensurately modulated and is based upon sheets of U6+and Mo6+polyhedra of unique topology. Four independent cationic sites partially occupied by Ba atoms are located between the sheets, together with H2O molecules.


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