Shimazakiite-4M and shimazakiite-4O, Ca2B2O5, two polytypes of a new mineral from Fuka, Okayama Prefecture, Japan

2013 ◽  
Vol 77 (1) ◽  
pp. 93-105 ◽  
Author(s):  
I. Kusachi ◽  
S. Kobayashi ◽  
Y. Takechi ◽  
Y. Nakamuta ◽  
T. Nagase ◽  
...  

AbstractShimazakiite occurs as greyish white aggregates up to 3 mm in diameter. Two polytypes, shimazakiite-4M and shimazakiite-4O, have been identified, the former in nanometre-sized twin lamellae and the latter in micrometre-sized lamellae. Shimazakiite was discovered in an irregular vein in crystalline limestone near gehlenite-spurrite skarns at Fuka mine, Okayama Prefecture, Japan. Associated minerals include takedaite, sibirskite, olshanskyite, parasibirskite, nifontovite, calcite and an uncharacterized hydrous calcium borate. The mineral is biaxial (–), with the following refractive indices (at 589 nm): α = 1.586(2), β = 1.650(2), γ = 1.667(2) and 2Vcalc = 53º [shimazakiite-4M]; and α = 1.584(2), β = 1.648(2), γ = 1.670(2) and 2Vcalc = 54.88º [shimazakiite-4O]. Quantitative electronmicroprobe analyses (means of 28 and 25 determinations) gave the empirical formulae Ca2B1.92O4.76(OH)0.24 and Ca2B1.92O4.76(OH)0.24 for shimazakiite-4M and shimazakiite-4O, respectively. The crystal structure refinements: P21/c, a = 3.5485(12), b = 6.352(2), c = 19.254(6) Å , β = 92.393(13)°, V = 433.6(3) Å3 [for shimazakiite-4M]; and P212121, a = 3.55645(8), b = 6.35194(15), c = 19.2534(5) Å , V = 434.941(18) Å3[for shimazakiite-4O], converged into R1 indices of 0.1273 and 0.0142, respectively. The crystal structure of shimazakiite consists of a layer containing B2O5 units (two near-coplanar triangular corner-sharing BO3 groups) and 6- and 7-coordinate Ca atoms. Different sequences in the c direction of four layers are observed in the polytypes. The five strongest lines in the powder-diffraction pattern [listed as d in Å (I)(hkl)] are: 3.02(84)(022); 2.92(100)(10) 2.81(56)(104); 2.76(32)(113); 1.880(32)(11,12,126,118) [for shimazakiite-4M]; and 3.84(33)(014); 3.02(42)(022); 2.86(100)(104); 2.79(29)(113); 1.903(44)(126,118) [for shimazakiite-4O].

2010 ◽  
Vol 74 (5) ◽  
pp. 863-869 ◽  
Author(s):  
S. J. Mills ◽  
A. R. Kampf ◽  
P. A. Williams ◽  
P. Leverett ◽  
G. Poirier ◽  
...  

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.


2005 ◽  
Vol 20 (3) ◽  
pp. 203-206 ◽  
Author(s):  
M. Grzywa ◽  
M. Różycka ◽  
W. Łasocha

Potassium tetraperoxomolybdate (VI) K2[Mo(O2)4] was prepared, and its X-ray powder diffraction pattern was recorded at low temperature (258 K). The unit cell parameters were refined to a=10.7891(2) Å, α=64.925(3)°, space group R−3c (167), Z=6. The compound is isostructural with potassium tetraperoxotungstate (VI) K2[W(O2)4] (Stomberg, 1988). The sample of K2[Mo(O2)4] was characterized by analytical investigations, and the results of crystal structure refinement by Rietveld method are presented; final RP and RWP are 9.79% and 12.37%, respectively.


2021 ◽  
Vol 59 (6) ◽  
pp. 1833-1863
Author(s):  
Andrew M. McDonald ◽  
Ingrid M. Kjarsgaard ◽  
Louis J. Cabri ◽  
Kirk C. Ross ◽  
Doreen E. Ames ◽  
...  

ABSTRACT Oberthürite, Rh3(Ni,Fe)32S32, and torryweiserite, Rh5Ni10S16, are two new platinum-group minerals discovered in a heavy-mineral concentrate from the Marathon deposit, Coldwell Complex, Ontario, Canada. Oberthürite is cubic, space group , with a 10.066(5) Å, V 1019.9(1) Å3, Z = 1. The six strongest lines of the X-ray powder-diffraction pattern [d in Å (I)(hkl)] are: 3.06(100)(311), 2.929(18)(222), 1.9518(39)(115,333), 1.7921(74)(440), 1.3184(15)(137,355) and 1.0312(30)(448). Associated minerals include: vysotskite, Au-Ag alloy, isoferroplatinum, Ge-bearing keithconnite, majakite, coldwellite, ferhodsite-series minerals (cuprorhodsite–ferhodsite), kotulskite, and mertieite-II, and the base-metal sulfides, chalcopyrite, bornite, millerite, and Rh-bearing pentlandite. Grains of oberthürite are up to 100 × 100 μm and the mineral commonly develops in larger composites with coldwellite, isoferroplatinum, zvyagintsevite, Rh-bearing pentlandite, and torryweiserite. The mineral is creamy brown compared to coldwellite and bornite, white when compared to torryweiserite, and gray when compared chalcopyrite and millerite. No streak or microhardness could be measured. The mineral shows no discernible pleochroism, bireflectance, or anisotropy. The reflectance values (%) in air for the standard COM wavelengths are: 36.2 (470 nm), 39.1 (546 nm), 40.5 (589 nm), and 42.3 (650 nm). The calculated density is 5.195 g/cm3, determined using the empirical formula and the unit-cell parameter from the refined crystal structure. The average result (n = 11) using energy-dispersive spectrometry is: Rh 10.22, Ni 38.83, Fe 16.54, Co 4.12, Cu 0.23 S 32.36, total 100.30 wt.%, which corresponds to (Rh2Ni0.67Fe0.33)Σ3.00(Ni19.30Fe9.09Co2.22Rh1.16Cu0.12)∑31.89S32.11, based on 67 apfu and crystallochemical considerations, or ideally, Rh3Ni32S32. The name is for Dr. Thomas Oberthür, a well-known researcher on alluvial platinum-group minerals, notably those found in deposits related to the Great Dyke (Zimbabwe) and the Bushveld complex (Republic of South Africa). Torryweiserite is rhombohedral, space group , with a 7.060(1), c 34.271(7) Å, V 1479.3(1), Z = 3. The six strongest lines of the X-ray powder-diffraction pattern [d in Å (I)(hkl)] are: 3.080(33)(021), 3.029(58)(116,0110), 1.9329(30)(036,1115,1210), 1.7797(100)(220,0216), 1.2512(49)(0416), and 1.0226(35)(060,2416,0232). Associated minerals are the same as for oberthürite. The mineral is slightly bluish compared to oberthürite, gray when compared to chalcopyrite, zvyagintsevite, and keithconnite, and pale creamy brown when compared to bornite and coldwellite. No streak or microhardness could be measured. The mineral shows no discernible pleochroism, bireflectance, or anisotropy. The reflectance values (%) in air for the standard COM wavelengths are: 34.7 (470 nm), 34.4 (546 nm), 33.8 (589 nm), and 33.8 (650 nm). The calculated density is 5.555 g/cm3, determined using the empirical formula and the unit-cell parameters from the refined crystal structure. The average result (n = 10) using wavelength-dispersive spectrometry is: Rh 28.02, Pt 2.56, Ir 1.98, Ru 0.10, Os 0.10, Ni 17.09, Fe 9.76, Cu 7.38, Co 1.77 S 30.97, total 99.73 wt.%, which corresponds to (Rh4.50Pt0.22Ir0.17Ni0.08Ru0.02Os0.01)∑5.00(Ni4.73Fe2.89Cu1.92Co0.50)Σ10.04S15.96, based on 31 apfu and crystallochemical considerations, or ideally Rh5Ni10S16. The name is for Dr. Thorolf (‘Torry') W. Weiser, a well-known researcher on platinum-group minerals, notably those found in deposits related to the Great Dyke (Zimbabwe) and the Bushveld complex (Republic of South Africa). Both minerals have crystal structures similar to those of pentlandite and related minerals: oberthürite has two metal sites that are split relative to that in pentlandite, and torryweiserite has a layered structure, comparable, but distinct, to that developed along [111] in pentlandite. Oberthürite and torryweiserite are thought to develop at ∼ 500 °C under conditions of moderate fS2, through ordering of Rh-Ni-S nanoparticles in precursor Rh-bearing pentlandite during cooling. The paragenetic sequence of the associated Rh-bearing minerals is: Rh-bearing pentlandite → oberthürite → torryweiserite → ferhodsite-series minerals, reflecting a relative increase in Rh concentration with time. The final step, involving the formation of rhodsite-series minerals, was driven via by the oxidation of Fe2+ → Fe3+ and subsequent preferential removal of Fe3+, similar to the process involved in the conversion of pentlandite to violarite. Summary comments are made on the occurrence and distribution of Rh, minerals known to have Rh-dominant chemistries, the potential existence of both Rh3+ and Rh2+, and the crystallochemical factors influencing accommodation of Rh in minerals.


2012 ◽  
Vol 76 (5) ◽  
pp. 1153-1163 ◽  
Author(s):  
L. Bindi ◽  
F. Nestola ◽  
A. Guastoni ◽  
L. Peruzzo ◽  
M. Ecker ◽  
...  

AbstractRaberite, ideally Tl5Ag4As6SbS15, is a new mineral from Lengenbach quarry in the Binn Valley, Valais, Switzerland. It occurs very rarely as euhedral crystals up to 150 m m across associated with yellow needle-like smithite, realgar, hatchite and probable trechmannite, edenharterite, jentschite and two unidentified sulfosalts. Raberite is opaque with a metallic lustre and has a dark brown–red streak. It is brittle with a Vickers hardness (VHN10) of 52 kg mm–2 (range 50–55) corresponding to a Mohs hardness of 2½–3. In reflected light raberite is moderately bireflectant and very weakly pleochroic from light grey to a slightly greenish grey. It is very weakly anisotropic with greyish to light blue rotation tints between crossed polars. Internal reflections are absent. Reflectance percentages for the four COM wavelengths [listed as Rmin, Rmax, (λ)] are 30.6, 31.8 (471.1 nm), 28.1, 29.3 (548.3 nm), 27.1, 28.0 (586.6 nm), and 25.8, 26.9 (652.3 nm).Raberite is triclinic, space group P1, with a = 8.920(1), b = 9.429(1), c = 20.062(3) Å, α = 79.66(1), β = 88.84(1), γ = 62.72(1)º, V = 1471.6(4) Å3 and Z = 2. The crystal structure [R1 = 0.0827 for 2110 reflections with I > 2σ(I)] consists of columns of nine-coordinate Tl atoms forming irregular polyhedra extending along [001] and forming sheets parallel to (010). The columns are decorated by cornersharing MS3 pyramids (M = As, Sb) and linked by AgS3 triangles. Of the seven M positions, one is dominated by Sb and the others by As; the mean M-S bond distances reflect As ↔ Sb substitution at these sites.The eight strongest lines in the powder diffraction pattern [dcalc in Å (I) (hkl)] are: 3.580 (100) (11̄3); 3.506 (58) (1̄23); 3.281 (73) (006); 3.017 (54) (1̄2̄3); 3.001 (98) (133); 2.657 (51) (226); 2.636 (46) (300); 2.591 (57) (330). A mean of 9 electron microprobe analyses gave Tl 39.55(13), Ag 18.42(8), Cu 0.06(2), As 17.08(7), Sb 5.61(6), S 19.15(11); total 99.87 wt.%, which corresponds to Tl4.85Ag4.28Cu0.02As5.72Sb1.16S14.97 with 31 atoms per formula unit. The new mineral has been approved by the IMA-CNMNC Commission (IMA 2012-017) and is named for Thomas Raber, an expert on Lengenbach minerals.


2013 ◽  
Vol 77 (3) ◽  
pp. 327-334 ◽  
Author(s):  
S. Anashkin ◽  
A. Bovkun ◽  
L. Bindi ◽  
V. Garanin ◽  
Y. Litvin

AbstractKudryavtsevaite, ideally Na3MgFe3+Ti4O12, is a new mineral from kimberlitic rocks of the Orapa area, Botswana. It occurs as rare prismatic crystals, up to 100 μm m across, associated with Mg-rich ilmenite, freudenbergite and ulvöspinel. Kudryavtsevaite is opaque with a vitreous lustre and shows a black streak. It is brittle; the Vickers hardness (VHN100) is 901 kg mm−2 (range: 876–925) (Mohs hardness ∼6). In reflected light, kudryavtsevaite is moderately bireflectant and very weakly pleochroic from dark grey to a slightly bluish grey. Under crossed polars, it is very weakly anisotropic with greyish-bluish rotation tints. Internal reflections are absent. Reflectance values (%), Rmin and Rmax, are: 21.3, 25.4 (471.1 nm), 20.6, 24.1 (548.3 nm), 20.0, 23.5 (586.6 nm) and 19.1, 22.4 (652.3 nm).Kudryavtsevaite is orthorhombic, space group Pnma, with a = 27.714(1), b = 2.9881(3), c = 11.3564(6) Å, V = 940.5(1) Å3, and Z = 4. The crystal structure [R1 = 0.0168 for 819 reflections with I > 2σ(I)] consists of edge-sharing and corner-sharing chains composed of Mg, Fe3+ and Ti atoms coordinated by six atoms of oxygen and running along the b axis, with Na filling the tunnels formed by the chains. The eight strongest powder-diffraction lines [d in Å (I/I0) (hkl)] are: 7.17 (100) (301), 4.84 (70) (302), 2.973 (35) (901), 2.841 (50) (004), 2.706 (50) (902), 2.541 (50) (312), 2.450 (70) (611), and 2.296 (45) (612). The average results of 12 electron microprobe analyses gave (wt.%): Na2O 16.46(15), CaO 1.01(3), MgO 5.31(5), Fe2O3 22.24(32), Cr2O3 1.05(6), Al2O3 0.03(2), TiO2 53.81(50), total 99.91, corresponding to the empirical formula (Na2.89Ca0.10)Σ2.99(Ti3.67Fe1.523+Mg0.72Cr0.08)Σ5.99O12, or ideally Na3MgFe3+Ti4O12.The new mineral has been approved by the IMA-CNMNC and named for Galina Kudryavtseva (1947–2006), a well known Russian mineralogist and founder of the Diamond Mineralogy Laboratory and scientific school for investigation of diamond mineralogy and geochemistry at the Lomonosov State University in Moscow, Russia.


ChemInform ◽  
2010 ◽  
Vol 33 (46) ◽  
pp. no-no
Author(s):  
Junichi Takahashi ◽  
Hisanori Yamane ◽  
Masahiko Shimada ◽  
Yoshinobu Yamamoto ◽  
Naoto Hirosaki ◽  
...  

2014 ◽  
Vol 78 (1) ◽  
pp. 1-9 ◽  
Author(s):  
L. Bindi ◽  
F. Nestola ◽  
E. Makovicky ◽  
A. Guastoni ◽  
L. De Battisti

AbstractPhilrothite, ideally TlAs3S5, is a new mineral from the Lengenbach quarry in the Binn Valley, Valais, Switzerland. It occurs as very rare crystals up to 200 mm across on realgar associated with smithite, rutile and sartorite. Philrothite is opaque with a metallic lustre and shows a dark brown streak. It is brittle; the Vickers hardness (VHN25) is 128 kg/mm2 (range: 120–137) (Mohs hardness of 3–3½). In reflected light philrothite is moderately bireflectant and weakly pleochroic from dark grey to light grey. Under crossed polars it is anisotropic with grey to bluish rotation tints. Internal reflections are absent. Reflectance percentages for the four COM wavelengths (Rmin and Rmax) are: 26.5, 28.8 (471.1 nm), 25.4, 27.2 (548.3 nm), 24.6, 26.3 (586.6 nm) and 24.0, 25.1 (652.3 nm), respectively.Philrothite is monoclinic, space group P21/c, with a = 8.013(2), b = 24.829(4), c = 11.762(3) Å, β = 132.84(2)°, V = 1715.9(7) Å3, Z = 8. It represents the N = 4 homologue of the sartorite homologous series. In the crystal structure [R1 = 0.098 for 1217 reflections with I > 2σ(I)], Tl assumes tricapped prismatic sites alternating to form columns perpendicular to the b axis. Between the zigzag walls of Tl coordination prisms, coordination pyramids of As(Sb) form diagonally-oriented double layers separated by broader interspaces which house the lone electron pairs of these elements.The eight strongest calculated powder-diffraction lines [d in Å(I/I0) (hkl)] are: 12.4145 (52) (020); 3.6768 (100) (61); 3.4535 (45) (131); 3.0150 (46) (53); 2.8941 (52) (81); 2.7685 (76) (230); 2.7642 (77) (34); 2.3239 (52) (092). A mean of five electron microprobe analyses gave Tl 26.28(12), Pb 6.69(8), Ag 2.50(4), Cu 0.04(2), Hg 0.07(2), As 32.50(13), Sb 3.15(3), S 26.35(10), total 97.58 wt.%, corresponding, on the basis of a total of nine atoms, to (Tl0.789Pb0.198)∑=0.987 (As2.662Sb0.159Ag0.142Cu0.004Hg0.002)∑=2.969S5.044. The new mineral has been approved by the Commission on New Minerals, Nomenclature and Classification (CNMNC) of the International Mineralogical Association (2013-066) and named for Philippe Roth (b. 1963), geophysicist and well known mineral expert on the Lengenbach minerals for more than 25 years.


2000 ◽  
Vol 56 (6) ◽  
pp. 998-1002 ◽  
Author(s):  
Thierry Bataille ◽  
Daniel Louër

From powder pattern indexing it has been demonstrated that [Y(H2O)]2(C2O4)(CO3)2, yttrium oxalate carbonate, crystallizes with orthorhombic symmetry, space group C2221, a = 7.8177 (7), b = 14.943 (1), c = 9.4845 (7) Å, V = 1108.0 (1) Å3, Z = 4. This unit cell displays a doubling of the c parameter, arising from weak diffraction lines observed in the powder diffraction pattern, with respect to results reported in the literature. The crystal structure has been solved ab initio using direct methods from powder data and has been confirmed by additional single-crystal data collected with a CCD area detector. The overall crystal structure is similar for both unit cells, except that an alternation of the carbonate groups in the direction parallel to the screw axis is displayed in the larger cell, while with the suggested half unit cell (space group C2mm) the carbonate groups would show only one orientation. The unit-cell determination strategy from single-crystal diffraction, collected with Nonius CAD-4 and Nonius Kappa CCD diffractometers, is discussed with respect to the results extracted from the powder diffraction pattern. The study demonstrates the power and usefulness of the full trace of a powder pattern for the detection of subtle structure details.


2000 ◽  
Vol 15 (3) ◽  
pp. 189-190 ◽  
Author(s):  
D. Sornadurai ◽  
B. Panigrahi ◽  
V. S. Sastry ◽  
Ramani

We report precision X-ray powder-diffraction (XRD) data of single phase pure Ti2ZrAl. Ti2ZrAl samples were prepared by an arc melting method and annealed at 1000 °C for 30 days. XRD analysis was carried out on these samples and it was found that Ti2ZrAl has a DO19 structure (space group P63/mmc, No. 194). The lattice parameters are found to be a=5.961±0.001 Å and c=4.793±0.001 Å.


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