scholarly journals Parisite-(La), ideally CaLa2(CO3)3F2, a new mineral from Novo Horizonte, Bahia, Brazil

2018 ◽  
Vol 82 (1) ◽  
pp. 133-144 ◽  
Author(s):  
Luiz A. D. Menezes Filho ◽  
Mario L. S. C. Chaves ◽  
Nikita V. Chukanov ◽  
Daniel Atencio ◽  
Ricardo Scholz ◽  
...  
Keyword(s):  
Single Crystal ◽  
Ir Spectrum ◽  
Empirical Formula ◽  
New Mineral ◽  
Formula Unit ◽  
Calculated Density ◽  
Oh Groups ◽  
Space Group ◽  
X Ray ◽  
Mohs Hardness

ABSTRACTParisite-(La) (IMA2016-031), ideally CaLa2(CO3)3F2, occurs in a hydrothermal vein crosscutting a metarhyolite of the Rio dos Remédios Group, at the Mula mine, Tapera village, Novo Horizonte county, Bahia, Brazil, associated with hematite, rutile, almeidaite, fluocerite-(Ce), brockite, monazite-(La), rhabdophane-(La) and bastnäsite-(La). Parisite-(La) occurs as residual nuclei (up to 5 mm) in steep doubly-terminated pseudo-hexagonal pyramidal crystals (up to 8.2 cm). Parisite-(La) is transparent, yellow-green to white, with a white streak and displays a vitreous (when yellow-green) to dull (when white) lustre. Cleavage is distinct on pseudo-{001}; fracture is laminated, conchoidal, or uneven. The Mohs hardness is 4 to 5, and it is brittle. Calculated density is 4.273 g cm−3. Parisite-(La) is pseudo-uniaxial (+), ω = 1.670(2) and ε = 1.782(5) (589 nm). The empirical formula normalized on the basis of 11 (O + F) atoms per formula unit (apfu) is Ca0.98(La0.83Nd0.51Ce0.37Pr0.16Sm0.04Y0.03)Σ1.94C3.03O8.91F2.09. The IR spectrum confirms the absence of OH groups. Single-crystal X-ray studies gave the following results: monoclinic (pseudo-trigonal), space group: C2, Cm, or C2/m, a = 12.356(1) Å, b = 7.1368(7) Å, c = 28.299(3) Å, β = 98.342(4)°, V = 2469.1(4) Å3 and Z = 12. Parisite-(La) is the La-dominant analogue of parisite-(Ce).

Vysokýite, U4+[AsO2(OH)2]4·4H2O, a new mineral from Jáchymov, Czech Republic

2013 ◽  
Vol 77 (8) ◽  
pp. 3055-3066 ◽  
Author(s):  
J. Plášil ◽  
J. Hloušek ◽  
R. Škoda ◽  
M. Novák ◽  
J. Sejkora ◽  
...  
Keyword(s):  
Czech Republic ◽  
Single Crystal ◽  
Empirical Formula ◽  
New Mineral ◽  
Wavelength Dispersive Spectroscopy ◽  
Oh Groups ◽  
X Ray ◽  
Cell Parameters ◽  
Perfect Cleavage ◽  
Mohs Hardness

AbstractVysokýite, U4+[(AsO2(OH)2]4(H2O)4 (IMA 2012–067), was found growing on an altered surface of massive native As in the Geschieber vein, Jáchymov ore district, Western Bohemia, Czech Republic. The new mineral was found in association with běhounekite, štěpite, kaatialaite, arsenolite, claudetite and gypsum. It forms extremely fibrous light-green crystals up to 8 mm long. Crystals have an alabaster lustre and a greenish-white to greyish streak. Vysokýite is brittle with uneven fracture and perfect cleavage along (100) and (001); the Mohs hardness is ∼2. A density of 3.393 g/cm3 was calculated using the empirical formula and unit-cell parameters obtained from a single-crystal diffraction experiment. Vysokýite is non-fluorescent under short or long wavelength UV radiation. It is colourless under the microscope, measured refractive indices are α' = 1.617(3), γ' = 1.654(3); the estimated optical orientation is α' ∼X, γ' ∼Z. The average of five spot wavelength dispersive spectroscopy (WDS) analyses is 29.44 UO2, 1.03 SiO2, 48.95 As2O5, 0.12 SO3, 15.88 H2O (calc.), total 95.42 wt.%. The empirical formula of vysokýite (based on 20 O a.p.f.u.) is U1.00[AsO2(OH)2]3.90(SiO4)0.16 (SO4)0.01·4H2O. The As–O–H and O–H vibrations dominate in the Raman spectrum. Vysokýite is triclinic, space group P, with a = 10.749(2), b = 5.044(3), c = 19.1778(7) Å, α = 89.872(15)°, β = 121.534(15)°, γ = 76.508(15)°, and V = 852.1(6) Å3, Z = 2 and Dcalc = 3.34 g·cm–3. The strongest diffraction peaks in the X-ray powder diffraction pattern are [dobs in Å (Irel.)(hkl)]: 8.872(100)(100), 8.067(50)(002), 6.399(7)(10), 4.773(6)(10), 3.411(10)(30), 3.197(18)(31). The crystal structure of vysokýite was solved from single-crystal X-ray diffraction data by the charge-flipping method and refined to R1 = 0.0595 based on 2718 unique observed reflection, and to wR2 = 0.1160 for all 4173 unique reflections. The structure of vysokýite consists of UO8 square antiprisms sharing all of their vertices with 8 As-tetrahedra to form infinite chains parallel to [010]. These chains are linked by hydrogen bonds involving terminal (OH) groups of the double-protonated As-tetrahedra and molecules of H2O located between the chains. The new mineral is named in honour of Arnošt Vysoký (1823–1872), the former chief of the Jáchymov mines and smelters, chemist and metallurgist.

Northstarite, a new lead-tellurite-thiosulfate mineral from the North Star mine, Tintic, Utah, USA

2020 ◽  
Vol 58 (4) ◽  
pp. 533-542
Author(s):  
Anthony R. Kampf ◽  
Robert M. Housley ◽  
George R. Rossman
Keyword(s):  
Raman Spectrum ◽  
Powder Diffraction ◽  
Electron Microprobe ◽  
Empirical Formula ◽  
New Mineral ◽  
Calculated Density ◽  
Space Group ◽  
X Ray ◽  
The North ◽  
Mohs Hardness

ABSTRACT Northstarite, Pb6(Te4+O3)5(S2O3), is a new mineral from the North Star mine, Tintic district, Juab County, Utah, USA. It is an oxidation-zone mineral occuring in a vug in massive quartz-baryte-enargite-pyrite in association with anglesite, azurite, chrysocolla, fluorapatite, plumbogummite, tellurite, zincospiroffite, and the new mineral adanite. Crystals are beige short prisms with pyramidal terminations, up to about 1 mm in length. The mineral is transparent to translucent with adamantine luster, white streak, Mohs hardness 2, brittle tenacity, irregular fracture, and no cleavage. The calculated density is 6.888 g/cm3. Northstarite is uniaxial (–) and nonpleochroic. The Raman spectrum is consistent with the presence of tellurite and thiosulfate groups and the absence of OH and H2O. Electron-microprobe analyses gave the empirical formula Pb5.80Sb3+0.05Te4+5.04S6+1.02S2–1.02O18. The mineral is hexagonal, space group P63, with a = 10.2495(5), c = 11.6677(8) Å, V = 1061.50(13) Å3, and Z = 2. The five strongest X-ray powder diffraction lines are [dobs Å(I)(hkl)]: 3.098(100)(113), 2.957(88)(300), 2.140(42)(223), 1.7335(41)(413), and 1.6256(31)(306). The structure (R1 = 0.033 for 1476 I > 2σI reflections) is a framework constructed of short (strong) Pb–O and Te–O bonds with channels along the 63 axes. The thiosulfate groups at the centers of the channels are only weakly bonded to the framework.

Putnisite, SrCa4Cr83+ (CO3)8SO4(OH)16·25H2O, a new mineral from Western Australia: description and crystal structure

2014 ◽  
Vol 78 (1) ◽  
pp. 131-144 ◽  
Author(s):  
P. Elliott ◽  
G. Giester ◽  
R. Rowe ◽  
A. Pring
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Western Australia ◽  
Empirical Formula ◽  
New Mineral ◽  
Orthorhombic Space Group ◽  
Calculated Density ◽  
X Ray ◽  
Area Detector ◽  
Mohs Hardness

AbstractPutnisite, SrCa4Cr83+ (CO7)8SO4(OH)16·25H2O, is a new mineral from the Polar Bear peninsula, Southern Lake Cowan, Western Australia, Australia. The mineral forms isolated pseudocubic crystals up to 0.5 mm in size in a matrix composed of quartz and a near amorphous Cr silicate. Putnisite is translucent, with a pink streak and vitreous lustre. It is brittle and shows one excellent and two good cleavages parallel to {100}, {010} and {001}. The fracture is uneven and the Mohs hardness 1½−2. The measured density is 2.20(3) g/cm3 and the calculated density based on the empirical formula is 2.23 g/cm3. Optically, putnisite is biaxial negative, with α = 1.552(3), β = 1.583(3) and γ = 1.599(3) (measured in white light). The optical orientation is uncertain and pleochroism is distinct: X pale bluish grey, Y pale purple, Z pale purple. Putnisite is orthorhombic, space group Pnma, with a = 15.351(3), b = 20.421(4) Å, c = 18.270(4) Å, V = 5727(2) Å3 (single-crystal data), and Z = 4. The strongest five lines in the X-ray powder diffraction pattern are [d(Å)(I)(hkl)]: 13.577 (100) (011), 7.659 (80) (200), 6.667 (43) (211), 5.084 (19) (222, 230), 3.689 (16) (411). Electron microprobe analysis (EMPA) gave (wt.%): Na2O 0.17, MgO 0.08, CaO 10.81, SrO 5.72, BaO 0.12, CuO 0.29, Cr2O3 31.13, SO3 3.95, SiO2 0.08, Cl− 0.28, CO2calc 17.94, H2Ocalc 30.30, O=Cl−0.06, total 100.81. The empirical formula, based on O + Cl = 69, is: Cr8.023+Ca3.78Sr1.08Na0.11Cu0.072+Mg0.04Ba0.02[(SO4)0.96(SiO4)0.03]0.99 (CO3)7.98(OH)16.19Cl0.15·24.84H2O. The crystal structure was determined from single-crystal X-ray diffraction data (MoKα, CCD area detector and refined to R1 = 5.84% for 3181 reflections with F0 > 4σF. Cr(OH)4O2 octahedra link by edge-sharing to form an eight-membered ring. A 10-coordinated Sr2+ cation lies at the centre of each ring. The rings are decorated by CO3 triangles, each of which links by corner-sharing to two Cr(OH)4O2 octahedra. Rings are linked by Ca(H2O)4O4 polyhedra to form a sheet parallel to (100). Adjacent sheets are joined along [100] by corner-sharing SO4 tetrahedra. H2O molecules occupy channels that run along [100] and interstices between slabs. Moderate to weak hydrogen bonding provides additional linkage between slabs.

Hydroniumpharmacosiderite, a new member of the pharmacosiderite supergroup from Cornwall, UK: structure and description

2010 ◽  
Vol 74 (5) ◽  
pp. 863-869 ◽  
Author(s):  
S. J. Mills ◽  
A. R. Kampf ◽  
P. A. Williams ◽  
P. Leverett ◽  
G. Poirier ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Diffraction Pattern ◽  
Powder Diffraction ◽  
Empirical Formula ◽  
Direct Methods ◽  
Structure Type ◽  
New Mineral ◽  
Calculated Density ◽  
X Ray ◽  
Mohs Hardness

AbstractHydroniumpharmacosiderite, ideally (H3O)Fe4(AsO4)3(OH)4·4H2O, is a new mineral from Cornwall, UK, probably from the St. Day group of mines. It occurs as a single yellowish green, slightly elongated cube, measuring 0.17 mm ×0.14 mm ×0.14 mm. The mineral is transparent with a vitreous lustre. It is brittle with a cleavage on {001}, has an irregular fracture, a white streak and a Mohs hardness of 2–3 (determined on H3O-exchanged pharmacosiderite). Hydroniumpharmacosiderite has a calculated density of 2.559 g cm–3 for the empirical formula. The empirical formula, based upon 20.5 oxygen atoms, is: [(H3O)0.50K0.48Na0.06]1.04(Fe3.79Al0.22)4.01[(As2.73P0.15)2.88O12](OH)4·4H2.14O. The five strongest lines in the X-ray powder diffraction pattern are [dobs(Å),Iobs,(hkl)]: 8.050,100,(001); 3.265,35,(112); 2.412,30,(113); 2.830,23,(202); 4.628,22,(111). Hydroniumpharmacosiderite is cubic, space group with a = 7.9587(2) Å, V = 504.11(2) Å3 and Z = 1. The crystal structure was solved by direct methods and refined to R1 = 0.0481 for 520 reflections with I > 2σ(I). The structure is consistent with determinations for H3O-exhchanged pharmacosiderite and the general pharmacosiderite structure type.

Gatehouseite, a new manganese hydroxy phosphate from Iron Monarch, South Australia

1993 ◽  
Vol 57 (387) ◽  
pp. 309-313 ◽  
Author(s):  
A. Pring ◽  
W. D. Birch
Keyword(s):  
Empirical Formula ◽  
Microprobe Analysis ◽  
South Australia ◽  
New Mineral ◽  
Calculated Density ◽  
X Ray ◽  
Pale Yellow ◽  
Orthorhombic Cell ◽  
Mohs Hardness ◽  
Hematite Ore

AbstractGatehouseite is a new manganese hydroxy phosphate from Iron Monarch, South Australia. The new mineral occurs as radiating clusters of pale yellow, and yellow to pale brownish orange bladed crystals up to 100 ~tm in length. The crystals are elongated along [010] and the principal forms are {102}, {110} and {001}. Gatehouseite also occurs as overgrowths on prismatic arsenoclasite crystals. Associated with gatehouseite are baryte, shigaite, manganoan ferroan calcite, hausmannite and hematite. Gatehouseite appears to have formed at low temperature by the interaction of phosphorus-rich fluids on hausmannite in carbonate-rich fractures in the hematite ore. Electron microprobe analysis yielded: MnO 64.42, FeO 0.19, CuO 0.03, ZnO 0.03, PbO 0.05, Al2O3 0.10, P2O5 22.18, V2O5 0.38, As2O5 3.58, H2O (6.44%). These data gave an empirical formula of Mn5.09Fe0.01Al0.01(P1.75As0.17-V0.02)∑1.94O8(OH)4.00, calculated on the basis of 12 oxygen atoms. The simplified formula is Mn5(PO4)2(OH)4. The mineral is transparent with a pale yellow streak, an adamantine lustre and an estimated Mohs hardness of 4. The crystals exhibit a distinct cleavage on {010} and have a splintery fracture. The strongest lines in the X-ray powder pattern are (dobs, Iobs, hkl) 4.48 (10) (004); 4.03 (10) (104); 2.900 (100) (11.5); 2.853 (70) (106); 2.801 (50) (021); 2.702 (80) (303); 2.022 (15) (322); 1.608(15) (330). These data were indexed on an orthorhombic cell, with a = 9.097(2), b = 5.693(2), c = 18.002(10) Å and a volume of 932.4(8) Å3; the space group is probably P212121. For Z = 4 and using the empirical formula, the calculated density is 3.74 g/cm3. Optical properties could not be determined in full; two refractive indices are 1.74(1) and 1.76(1) (white light); pleochroism is distinct from brown to near colourless. The crystals are length slow with parallel extinction. The name is for Dr. Bryan Michael Kenneth Cummings Gatehouse (1932-), crystal chemist of Monash University, Melbourne, Australia.

Kurilite – Ag8Te3Se – a new mineral from the Prasolovskoe deposit, Kuril islands, Russian Federation

2010 ◽  
Vol 74 (3) ◽  
pp. 463-468 ◽  
Author(s):  
V. A. Kovalenker ◽  
O. Yu. Plotinskaya ◽  
C. J. Stanley ◽  
A. C. Roberts ◽  
A. M. McDonald ◽  
...  
Keyword(s):  
Russian Federation ◽  
Empirical Formula ◽  
Polarized Light ◽  
New Mineral ◽  
Unit Cell Parameters ◽  
Calculated Density ◽  
X Ray ◽  
Cell Parameters ◽  
Kunashir Island ◽  
Mohs Hardness

AbstractKurilite, with the simplified formula, Ag8Te3Se, is a new mineral from the Prasolovskoe epithermal Au-Ag deposit, Kunashir Island, Kuril arc, Russian Federation. It occurs as aggregates up to 2 mm in size, composed of brittle xenomorphic grains, up to several μm in size, in quartz, associated with tetrahedrite, hessite, sylvanite and petzite. Kurilite is opaque, grey, with a metallic lustre and a black streak. Under plane-polarized light, kurilite is white with no observed bireflectance, cleavage, or parting observed. Under crossed polars it appears isotropic without internal reflections. Reflectance values in air and in oil, are tabulated. It has a mean VHN (25 g load) of 99.9 kg/mm2 which equates roughly to a Mohs hardness of 3. Electron microprobe analyses yield a mean composition of Ag 63.71, Au 0.29, Te 29.48, Se 5.04, S 0.07, total 98.71 wt.%. The empirical formula (based on 12 atoms) is (Ag7.97Au0.02)Σ7.99Te3.00(Se0.86Te0.12S0.03)Σ1.01. The calculated density is 7.799 g/cm3 (based on the empirical formula and unit-cell parameters refined from single-crystal data). Kurilite is rhombohedral, R3 or , a 15.80(1), c 19.57(6) Å, V 4231(12)Å3, c:a 1.2386, Z = 15. Its crystal structure remains unsolved. The seven strongest lines of the X-ray powder-diffraction pattern [d in Å (I)(hkl)] are: 3.727(20)(131), 2.996(50)(232), 2.510(30)(226,422), 2.201(100)(128,416,342), 2.152(20)(603), 2.079(30)(253), 2.046(20)(336,434). The mineral is named after the locality.

Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups:d escription and crystal structure

2011 ◽  
Vol 75 (6) ◽  
pp. 2721-2732 ◽  
Author(s):  
L. Bindi ◽  
F. Nestola ◽  
U. Kolitsch ◽  
A. Guastoni ◽  
F. Zorzi
Keyword(s):  
Empirical Formula ◽  
Optical Data ◽  
New Mineral ◽  
Orthorhombic Space Group ◽  
Calculated Density ◽  
X Ray ◽  
Cell Parameters ◽  
Mohs Hardness ◽  
Ray Density ◽  
Oxygen Atoms

AbstractFassinaite, ideally Pb22+(S2O3)(CO3), is a new mineral from the Trentini mine, Mount Naro, Vicenza Province, Veneto, Italy (holotype locality). It is also reported from the Erasmus adit, Schwarzleo District, Leogang, Salzburg, Austria and the Friedrich-Christian mine, Schapbach, Black Forest, Baden-Wurttemberg, Germany (cotype localities). At the Italian type locality it occurs as acicular [010]. colourless crystals up to 200 μn long, closely associated with galena, quartz and anglesite. At the Austrian cotype locality it is associated with cerussite, rare sulphur and very rare phosgenite. At the German cotype locality anglesite is the only associated phase. Fassinaite crystals commonly have flat chisel-shaped terminations. They are transparent with vitreous to adamantine lustre and a white streak. Fassinaite is brittle with an irregular fracture and no discernible cleavage; the estimated Mohs hardness is 11/2—2. The calculated density for the type material is 6.084 g cm–3 (on the basis of the empirical formula), whereas the X-ray density is 5.947 g cm–3. In common with other natural lead thiosulphates (i.e. sidpietersite and steverustite) fassinaite has intense internal reflections, which do not allow satisfactory optical data to be collected; the crystals are length-slow and have very high birefringence. The mineral is not fluorescent.Fassinaite is orthorhombic, space group Pnma, with unit-cell parameters (for the holotype material) a = 16.320(2), b = 8.7616(6), c = 4.5809(7) Å, V = 655.0(1) Å3, a:b:c = 1.863:1:0.523, Z = 4. Single-crystal structural studies were carried out on crystals from all three localities: R1(F) values range between 0.0353 and 0.0596. The structure consists of rod-like arrangements of Pb-centred polyhedra that extend along the [010] direction. These ‘rods’ are linked, alternately, by (CO3)2– and (S2O3)2– groups. The (S2O3)2– groups point alternately left and right (in a projection on [001] with [010] set vertical) if the apex occupied by the S2– in the thiosulphate group is defined to be the atom giving the direction. The lead atoms are nine-coordinated by seven oxygen atoms and two sulphur (S2–) atoms. The eight strongest X-ray powder-diffraction lines [d in Å (I/I0) (hkl)] are: 4.410 (39) (101), 4.381 (59) (020), 4.080 (62) (400), 3.504 (75) (301), 3.108 (100) (121), 2.986 (82) (420), 2.952 (49) (221) and 2.736 (60) (321). Electron-microprobe analyses produce an empirical formula Pb2.01(1)(S1.82(2)O3)CO3 (on the basis of six oxygen atoms). The presence of both carbonate and thiosulphate groups was corroborated by Raman spectra, which are discussed in detail. Fassinaite is named after Bruno Fassina (b. 1943), an Italian mineral collector who discovered the mineral in 2009.

scholarly journals Joteite, Ca2CuAl[AsO4][AsO3(OH)]2(OH)2·5H2O, a new arsenate with a sheet structure and unconnected acid arsenate groups

2013 ◽  
Vol 77 (6) ◽  
pp. 2811-2823 ◽  
Author(s):  
A. R. Kampf ◽  
S. J. Mills ◽  
R. M. Housley ◽  
G. R. Rossman ◽  
B. P. Nash ◽  
...  
Keyword(s):  
Empirical Formula ◽  
New Mineral ◽  
Optical Orientation ◽  
Secondary Mineral ◽  
Calculated Density ◽  
X Ray ◽  
Cell Parameters ◽  
Perfect Cleavage ◽  
Mohs Hardness ◽  
Greenish Blue

AbstractJoteite (IMA2012-091), Ca2CuAl[AsO4][AsO3(OH)]2(OH)2·5H2O, is a new mineral from the Jote mine, Tierra Amarilla, Copiapó Province, Atacama, Chile. The mineral is a late-stage, low-temperature, secondary mineral occurring with conichalcite, mansfieldite, pharmacoalumite, pharmacosiderite and scorodite in narrow seams and vughs in the oxidized upper portion of a hydrothermal sulfide vein hosted by volcanoclastic rocks. Crystals occur as sky-blue to greenish-blue thin blades, flattened and twinned on {001}, up to ~300 μm in length, and exhibiting the forms {001}, {010}, {10}, {20} and {111}. The blades are commonly intergrown in wheat-sheaf-like bundles, less commonly in sprays, and sometimes aggregated as dense crusts and cavity linings. The mineral is transparent and has a very pale blue streak and vitreous lustre. The Mohs hardness is estimated at 2 to 3, the tenacity is brittle, and the fracture is curved. It has one perfect cleavage on {001}. The calculated density based on the empirical formula is 3.056 g/cm3. It is optically biaxial (–) with α = 1.634(1), β = 1.644(1), γ = 1.651(1) (white light), 2Vmeas = 78(2)° and 2Vcalc = 79.4°. The mineral exhibits weak dispersion, r < v. The optical orientation is X ≈ c*; Y ≈ b*. The pleochroism is Z (greenish blue) > Y (pale greenish blue) > X (colourless). The normalized electron-microprobe analyses (average of 5) provided: CaO 15.70, CuO 11.22, Al2O38.32, As2O546.62, H2O 18.14 (structure), total 100 wt.%. The empirical formula (based on 19 O a.p.f.u.) is: Ca1.98Cu1.00Al1.15As2.87H14.24O19. The mineral is slowly soluble in cold, concentrated HCl. Joteite is triclinic, P1, with the cell parameters: a = 6.0530(2), b = 10.2329(3), c = 12.9112(4) Å, α = 87.572(2), β = 78.480(2), γ = 78.697(2)°, V = 768.40(4) Å3 and Z = 2. The eight strongest lines in the X-ray powder diffraction pattern are [dobs Å (I)(hkl)]: 12.76(100)(001), 5.009(23)(020), 4.206(26)(120,003,121), 3.92(24)(022,02,02), 3.40(25)(1̄13), 3.233(19)(031,023,123,02̄3), 2.97(132,201) and 2.91(15)(22,13). In the structure of joteite (R1 = 7.72% for 6003 Fo > 4σF), AsO4 and AsO3 (OH) tetrahedra, AlO6 octahedra and Cu2+O5 square pyramids share corners to form sheets parallel to {001}. In addition, 7- and 8-coordinate Ca polyhedra link to the periphery of the sheets yielding thick slabs. Between the slabs are unconnected AsO3(OH) tetrahedra, which link the slabs only via hydrogen bonding. The Raman spectrum shows features consistent with OH and/or H2O in multiple structural environments. The region between the slabs may host excess Al in place of some As.

Quaternary Phosphide Oxides Pr3Cu4P4O2–x and Sm3Cu4P4O2–x with Ordered Zr3Cu4Si6-Type Structure

2002 ◽  
Vol 57 (2) ◽  
pp. 165-170 ◽  
Author(s):  
Joachim W. Kaiser ◽  
Wolfgang Jeitschko
Keyword(s):  
Single Crystal ◽  
Chemical Bonding ◽  
Empirical Formula ◽  
Type Structure ◽  
Formula Unit ◽  
Variable Parameters ◽  
Space Group ◽  
X Ray ◽  
Structure Space ◽  
Structure Factors

The compounds Ln3Cu4P4O2-χ (Ln = Pr, Sm) were prepared by annealing the elemental components in a NaCl/KCl flux. They crystallize with an ordered Zr3Cu4Si6-type structure (space group I4/mmm, Z = 2), which was refined from single-crystal X-ray data for both compounds; Pr3Cu4P4O2-χ: a = 397.8(1), c = 2658.7(3) pm, R = 0.046 for 235 structure factors and 19 variable parameters; Sm3Cu4P4O2-χ: a = 392.8(1), c = 2643.6(3) pm, R = 0.057 for 145 F values and 19 variables. The refinements showed partial occupancy for the oxygen positions resulting in approximately 1.5 oxygen atoms per formula unit. Half of the phosphorus atoms form pairs with typical two-electron bond distances of 222.8(4) and 221.7(8) pm, respectively. Using oxidation numbers chemical bonding in these phosphide oxides can be rationalized with the formula (Ln+3)3(Cu+1)4(P-P)-4(P-3)2(O-2)1.5. Hence, the empirical formula may also be doubled (Ln6Cu8P8O3), and the compounds are expected to be semiconducting.

Redgillite, Cu6(OH)10(SO4)·H2O, a new mineral from Caldbeck Fells, Cumbria, England: description and crystal structure

2005 ◽  
Vol 69 (6) ◽  
pp. 973-980 ◽  
Author(s):  
J. J. Pluth ◽  
I. M. Steele ◽  
A. R. Kampf ◽  
D. I. Green
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Cross Section ◽  
New Mineral ◽  
Calculated Density ◽  
Oh Groups ◽  
X Ray ◽  
Jahn Teller ◽  
Mohs Hardness ◽  
Measured Density

AbstractRedgillite, Cu6(OH)10(SO4)·H2O, space group P21/c, a 3.155(3) Å, b 10.441(8) Å, c 19.436(16) Å, β 90.089(13)°, V = 640.2(9) Å3, Z = 2, is a new mineral from Silver Gill, Caldbeck Fells, Cumbria, England. The strongest six lines of the X-ray powder-diffraction pattern [d in Å, (I)(hkl)] are: 9.72 (90) (002), 7.11 (100) (012), 4.60 (30) (022), 4.068 (20) (023), 2.880 (30) (112,112̄), 2.318 (50) (131,131̄). It occurs as translucent to transparent grass-green bladed crystals up to 0.15 mm long with squared-off or tapering terminations; usually in radiating groups. Forms observed are {001} prominent, {010} as composite stepped faces, and {100} irregular. Redgillite has white streak, vitreous lustre and Mohs hardness of ∼2. Blades are slightly flexible with irregular fracture and exhibit a perfect {001} cleavage and good {100} and {010} cleavages. The measured density (by sink-float) is 3.45(5) g/cm3; the calculated density is 3.450 g/cm3. The mineral dissolves slowly in dilute HCl. Redgillite is biaxial- negative with α = 1.693(2), β = 1.721(2), γ = 1.723(2), 2V = 30(2)° (meas.) and 30° (calc.); dispersion is r > v, medium; pleochroism: Y blue-green α X blue-green α Z yellow-green; orientation: X ≈ c , Y = b, Z ≈ a. Electron microprobe analyses yielded CuO 68.9, SO3 11.6, total 80.5. With water inferred from the structure analysis, the empirical formula is: Cu5.995(OH)9.991(SO4)1.003·H2O. Redgillite is typically found in thin fractures in partly oxidized sulphides where it is commonly associated with langite and more rarely with malachite, cuprite, connellite and brochantite. The name is for the Red Gill mine, from which the mineral is best known. The crystal structure of redgillite was determined and refined to R = 0.090 for 1529 observed reflections [I > 2σ(I)]. The redgillite structure consists of Jahn-Teller distorted CuO6 octahedra and SO4 tetrahedra. The octahedra share edges to form sheets that are zig-zag in cross section. The SO4 tetrahedra share an oxygen with the Cu layer and link the layers by hydrogen bonds to OH groups. The crystal structures of wroewolfeite, langite, posnjakite, spangolite and schulenbergite are similar to redgillite. They all contain edge sharing CuO6 layers connected to SO4 groups with the layers bridged via hydrogen bonds.

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