30 results on '"Nestola, F."'
Search Results
2. Rüdlingerite, Mn2+2V5+As5+O7·2H2O, a New Species Isostructural with Fianelite
- Author
-
Roth P.[1], Meisser N.[2], Nestola F.[3], koda R.[4], Cámara F.[5], Bosi F.[6, Ciriotti M.E.[8, Hålenius U.[10], Schnyder C.[2, 11], and Bracco R.[12]
- Subjects
crystal structure ,lcsh:QE351-399.2 ,010504 meteorology & atmospheric sciences ,Metamorphic rock ,chemistry.chemical_element ,Crystal structure ,Manganese ,new mineral species ,010502 geochemistry & geophysics ,01 natural sciences ,Formula unit ,Fianel mine ,Isostructural ,0105 earth and related environmental sciences ,Rüdlingerite ,lcsh:Mineralogy ,Valletta mine ,Chemistry ,Scattering ,arsenic ,Geology ,Geokemi ,Geotechnical Engineering and Engineering Geology ,Arsenic ,Fianelite ,Italy ,Switzerland ,Vanadium ,Crystallography ,Geochemistry ,Octahedron ,vanadium ,fianelite ,Monoclinic crystal system ,rüdlingerite - Abstract
The new mineral species rü, dlingerite, ideally Mn2+2V5+As5+O7·, 2H2O, occurs in the Fianel mine, in Val Ferrera, Grisons, Switzerland, a small Alpine metamorphic Mn deposit. It is associated with ansermetite and Fe oxyhydroxide in thin fractures in Triassic dolomitic marbles. Rü, dlingerite was also found in specimens recovered from the dump of the Valletta mine, Canosio, Cuneo, Piedmont, Italy, where it occurs together with massive braccoite and several other As- and V-rich phases in richly mineralized veins crossing the quartz-hematite ore. The new mineral displays at both localities yellow to orange, flattened elongated prismatic, euhedral crystals measuring up to 300 &mu, m in length. Electron-microprobe analysis of rü, dlingerite from Fianel gave (in wt%): MnO 36.84, FeO 0.06, As2O5, 25.32, V2O5 28.05, SiO2 0.13, H2Ocalc 9.51, total 99.91. On the basis of 9 O anions per formula unit, the chemical formula of rü, dlingerite is Mn1.97(V5+1.17 As0.83Si0.01)&Sigma, 2.01O7·, 2H2O. The main diffraction lines are [dobs in Å, (Iobs) hkl]: 3.048 (100) 022, 5.34 (80) 120, 2.730 (60) 231, 2.206 (60) 16-1, 7.28 (50) 020, 2.344 (50) 250, 6.88 (40) 110, and 2.452 (40) 320. Study of the crystal structure showcases a monoclinic unit cell, space group P21/n, with a = 7.8289(2) Å, b = 14.5673(4) Å, c = 6.7011(2) Å, &beta, = 93.773(2)°, V = 762.58(4) Å, 3, Z = 4. The crystal structure has been solved and refined to R1 = 0.041 on the basis of 3784 reflections with Fo >, 4&sigma, (F). It shows Mn2+ hosted in chains of octahedra that are subparallel to [-101] and bound together by pairs of tetrahedra hosted by V5+ and As5+, building up a framework. Additional linkage is provided by hydrogen-bonding through H2O coordinating Mn2+ at the octahedra. One tetrahedrally coordinated site is dominated by V5+, T(1)(V0.88As0.12), corresponding to an observed site scattering of 24.20 electrons per site (eps), whereas the second site is strongly dominated by As5+,T(2)(As0.74V0.26), with, accordingly, a higher observed site scattering of 30.40 eps. The new mineral has been approved by the IMA-CNMNC and named for Gottfried Rü, dlinger (born 1919), a pioneer in the 1960&ndash, 1980s, in the search and study of the small minerals from the Alpine manganese mineral deposits of Grisons.
- Published
- 2020
- Full Text
- View/download PDF
3. Redetermination and new description of the crystal structure of vanthoffite, Na6Mg(SO4)4.
- Author
-
Balić-Žunić, T., Pamato, M. G., and Nestola, F.
- Subjects
CRYSTAL structure ,TETRAHEDRA ,POLYHEDRA ,MINERALS ,SPACE groups ,DIMERS ,SULFATES - Abstract
The crystal structure of vanthoffite {hexasodium magnesium tetrakis[sulfate(VI)]}, Na
6 Mg(SO4 )4 , was solved in the year 1964 on a synthetic sample [Fischer & Hellner (1964). Acta Cryst. 17, 1613]. Here we report a redetermination of its crystal structure on a mineral sample with improved precision. It was refined in the space group P21 /c from a crystal originating from Surtsey, Iceland. The unique Mg (site symmetry 1̅) and the two S atoms are in usual, only slightly distorted octahedral and tetrahedral coordinations, respectively. The three independent Na atoms are in a distorted octahedral coordination (1×) and distorted 7-coordinations intermediate between a `split octahedron' and a pentagonal bipyramid (2×). [MgO6 ] coordination polyhedra interchange with one half of the sulfate tetrahedra in <011> chains forming a (100) meshed layer, with dimers formed by edge-sharing [NaO7 ] polyhedra filling the interchain spaces. The other [NaO7 ] polyhedra are organized in a parallel layer formed by [010] and [001] chains united through edge sharing and bonds to the remaining half of sulfate groups and to [NaO6 ] octahedra. The two types of layers interconnect through tight bonding, which explains the lack of morphological characteristics typical of layered structures. [ABSTRACT FROM AUTHOR]- Published
- 2020
- Full Text
- View/download PDF
4. Mapiquiroite, (Sr,Pb)(U,Y)Fe2(Ti,Fe3+)18O38, a new member of the crichtonite group from Apuan Alps, Tuscany, Italy
- Author
-
Biagioni C.[1], Orlandi P. [1, Pasero M.[1], Nestola F.[3], and Bindi L. [4]
- Subjects
Anatase ,crystal structure ,Baryte ,Analytical chemistry ,Mineralogy ,mapiquiroite ,crichtonite group ,new mineral ,strontium uranium iron titanate ,Buca della Vena ,Monte Arsiccio ,Apuan Alps ,Tuscany ,Italy ,engineering.material ,Siderite ,chemistry.chemical_compound ,Geochemistry and Petrology ,Isostructural ,Quartz ,Sphalerite ,chemistry ,Rutile ,engineering ,Pyrite ,Geology - Abstract
Mapiquiroite, (Sr,Pb)(U,Y)Fe 2 (Ti,Fe 3+ ) 18 O 38 , was identified as a new mineral from the baryte + pyrite + iron oxide ores of Buca della Vena (BdV) and Monte Arsiccio (MA) mines, Apuan Alps, Tuscany, Italy. At BdV, mapiquiroite occurs as complex rhombohedral or tabular pseudo-hexagonal crystals, up to 1 mm in size, black in colour, with a sub-metallic lustre, in quartz + ‘adularia’ + baryte veins embedded in schists, in association with allanite-(Ce), anatase, destinezite, gypsum, monazite-(Ce), pyrite, rutile, and ‘tourmaline’; at MA, mapiquiroite forms tabular pseudo-hexagonal crystals, up to 5 mm in size, in quartz + carbonate veins embedded in magnetite-rich dolostones, in association with baryte, boulangerite, derbylite, siderite, and sphalerite. Under the microscope, mapiquiroite is blackish in colour, weakly bireflectant, and non-pleochroic. Internal reflections are absent. Anisotropism is distinct, without characteristic rotation tints. Minimum and maximum reflectance data for COM wavelengths [λ (nm), R air (%); data for the specimens from BdV and MA, respectively] are: 471.1, 17.0/17.2 and 17.7/18.0; 548.3, 16.7/17.0 and 17.6/17.8; 586.6, 16.4/16.7 and 17.3/17.7; 652.3, 16.1/16.3 and 17.0/17.3. Vickers hardness is 750 kg · mm −2 and 782 kg·mm −2 for specimens from BdV and MA, respectively, corresponding to a Mohs’ hardness ~ 6. The chemical data point to the formulae (Sr 0.533 La 0.176 Pb 0.105 Na 0.030 Ca 0.026 ) ∑=0.870 (U 0.407 Ce 0.101 Y 0.205 Mn 0.072 ) ∑=0.785 Fe 3+ 2.000 (Ti 12.423 Fe 3+ 3.345 Cr 1.624 V 5+ 0.129 Al 0.032 Sn 0.013 Nb 0.007 ) ∑=17.573 O 38 (BdV) and (Sr 0.312 Pb 0.248 Na 0.019 Ca 0.014 La 0.009 ) ∑=0.602 (U 0.858 Y 0.070 Ce 0.021 Mn 0.005 ) ∑=0.954 (Fe 3+ 1.695 Zn 0.305 ) ∑=2.000 (Ti 12.070 Fe 3+ 4.987 V 5+ 0.372 Al 0.030 Nb 0.030 Cr 0.015 Sn 0.001 ) ∑=17.505 O 38 (MA). Mapiquiroite is trigonal, R 3, with a 10.3719(7), c 20.875(1) A, V 1944.8(2) A 3 and a 10.3854(3), c 20.8942(6) A, V 1951.7(1) A 3 for the specimens from BdV and MA, respectively. The crystal structures of mapiquiroite from these two occurrences were refined to R 1 = 0.028 and 0.032, respectively. Mapiquiroite is isostructural with other members of the crichtonite group. The name mapiquiroite honours four Italian mineral collectors, Riccardo Mazzanti, Luigi Pierotti, Ugo Quilici, and Moreno Romani for their contribution to the study of the mineralogy of baryte + pyrite + iron oxide deposits from the Apuan Alps.
- Published
- 2014
5. Tazzoliite: a new mineral with a pyrochlore-related structure from Euganei hills, Padova (Italy)
- Author
-
Camara F. [1], Nestola F. [2], Bindi L. [3], Guastoni A. [4], Zorzi F. [2], Peruzzo L. [5], and Pedron D. [6]
- Subjects
tazzoliite new mineral ,crystal structure ,pyrochlore ,Raman spectroscopy ,Euganei Hills - Abstract
Tazzoliite, ideally Ba2CaSr0.5Na0.5Ti2Nb3SiO17[PO2(OH)(2)](0.5), is a new mineral (IMA 2011-018) from Monte delle Basse, Euganei Hills, Galzignano Terme, Padova, Italy. It occurs as lamellar pale orange crystals, which are typically a few mu m thick and up to 0.4 mm long, closely associated with a diopsidic pyroxene and titanite. Tazzoliite is transparent. It has a white streak, a pearly lustre, is not fluorescent and has a hardness of 6 (Mohs' scale). The tenacity is brittle and the crystals have a perfect cleavage along {010}. The calculated density is 4.517 g cm(-3). Tazzoliite is biaxial (-) with 2V(meas) of similar to 50 degrees, it is not pleochroic and the average refractive index is 2.04. No twinning was observed. Electron-microprobe analyses gave the following chemical formula: (Ba1.93Ca1.20Sr0.52Na0.25Fe0.102+)(Sigma 4) (Nb2.88Ti2.05Ta0.07Zr0.01V0.015+)(Sigma 5.02)SiO17[(P0.13Si0.12S0.07)(Sigma 0.32)O-0.66(OH)(0.66)][F-0.09(OH)(0.23)](Sigma 0.32). Tazzoliite is orthorhombic, space group Fmmm, with unit-cell parameters a = 7.4116(3), b = 20.0632(8), c = 21.4402(8) angstrom, V = 3188.2(2) angstrom(3) and Z = 8. The crystal structure, obtained from single-crystal X-ray diffraction data, was refined to R-1(F-2) = 0.063. It consists of a framework of Nb(Ti) octahedra and BaO7 polyhedra sharing apexes or edges, and Si tetrahedra sharing apexes with Nb(Ti) octahedra and BaO7 polyhedra. The structure, which is related to the pyrochlore structure, contains three Nb(Ti) octahedra: two are Nb dominant and one is Ti dominant. Chains of A2O(8) polyhedra [A2 being occupied by Sr(Ca,Fe)] extend along [100] and are surrounded by Nb octahedra. Channels formed by six Nb(Ti) octahedra and two tetrahedra, or four A2O(8)(OH) polyhedra (A1 being occupied by Ba), alternate along [100]. The channels are partially occupied by [PO2(OH)(2)] in two possible mutually exclusive positions, alternating with fully occupied A3O(7) polyhedral pairs [A3 being occupied by Ca(Na)]. The seven strongest X-ray powder diffraction lines [d in angstrom (I/I-0) (hkl)] are: 3.66 (60) (044), 3.16 (30) (153), 3.05 (100) (204), 2.98 (25) (240), 2.84 (50) (064), 1.85 (25) (400) and 1.82 (25) (268). Raman spectra of tazzoliite were collected in the range 150-3700 cm(-1) and confirm the presence of OH groups. Tazzoliite is named in honour of Vittorio Tazzoli in recognition of his contributions to the fields of mineralogy and crystallography.
- Published
- 2012
6. Te-rich canfieldite, AG8SN(S,TE)6, from the Legenbach Quarry, Binntal, Canton Valais, Switzerland: Occurrence, description and crystal structure
- Author
-
Bindi L. [1, 2], Nestola F.[3], Guastoni A. [4], Zorzi F. [3], and Peruzzo L. [5], Raber T.
- Subjects
crystal structure ,chemical composition ,Lengenbach ,Switzerland - Abstract
In order to evaluate the effects of Te-for-S substitution in the minerals of the argyrodite group, the crystal structure and chemical composition of a crystal of Te-rich canfieldite from the Lengenbach quarry, Binntal, Switzerland, was investigated. The unit-cell parameters are a 11.0003(6) angstrom and V 1331.1(1) angstrom(3). The structure was solved and refined in the space group F (4) over bar 3m to R-1 = 0.0308 for 194 independent reflections and 21 parameters. Quantitative analysis led to the chemical formula Ag-8.05(Sn1.03Ge0.01)(Sigma 1.04)(S3.95Te1.95Se0.01)(Sigma 5.91), ideally Ag8Sn(S,Te)(6). The crystal structure of Te-rich canfieldite was found to be topologically identical to that of putzite, (Cu4.7Ag3.3)GeS6. Neglecting the short Ag-Ag contacts (due to disorder), the two Ag atoms in the structure can be considered as three-fold (Ag1) and four-fold (Ag2) coordinated. Tin adopts a regular tetrahedral coordination. The refinement of the site-occupancy factor indicates Te to be disordered over the three anion positions (i.e., X1, X2, and X3), with a preference for the X1 site.
- Published
- 2012
7. Raberite, Tl5Ag4As6SbS15, a new Tl-bearing sulfosalt from Lengenbach quarry, Binn valley, Switzerland: description and crystal structure
- Author
-
Bindi L. [1, 2], Nestola F. [3], Guastoni A. [4], Peruzzo L. [5], Ecker M.[6], and Carampin R. [5]
- Subjects
crystal structure ,Lengenbach ,new mineral ,Tl-sulfosalts ,Switzerland - Abstract
Raberite, 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 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, (?)] 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, ? = 79.66(1), ? = 88.84(1), ? = 62.72(1)°, V = 1471.6(4) Å3 and Z = 2. The crystal structure [R1 = 0.0827 for 2110 reflections with I > 2?(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 corner-sharing 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 AsSb substitution at these sites. The eight strongest lines in the powder diffraction pattern [dcalc in Å (I) (hkl)] are: 3.580 (100) (11?3); 3.506 (58) (1?2?3); 3.281 (73) (006); 3.017 (54) (1?23); 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.
- Published
- 2012
8. Fassinaite, Pb22+(S6+O3S2-)(C4+O3), the first mineral with coexisting carbonate and thiosulfate groups: Description and crystal structure
- Author
-
Bindi, L. [ 1,2 ], Nestola, F. [ 3 ], Kolitsch, U. [ 4,5 ], Guastoni, A. [ 6 ], and Zorzi, F. [ 3 ]
- Subjects
crystal structure ,Raman spectroscopy ,new mineral ,fassinaite ,thiosulphate - Abstract
Fassinaite, ideally Pb-2(2+)(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 mu m 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 arc 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 1 1/2-2. 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 arc length-slow and have very high birefringence. The mineral is not fluorescent. Fassinaite is orthorhombic, space group Pupa, with unit-cell parameters (for the holotype material) a = 16.320(2), b = 8.7616(6), c = 4.5809(7) angstrom, V = 655.0(1) angstrom(3), a:b:c = 1.863:1:0.523, Z = 4. Single-crystal structural studies were carried out on crystals from all three localities: R-1(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 angstrom (I/I-0)(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 Pb-2.01(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.
- Published
- 2011
9. As-Nb solid solution in β-fergusonite-(Y) from Mount Cervandone
- Author
-
CAMARA ARTIGAS, Fernando, Guastoni, A, and Nestola, F.
- Subjects
β-fergusonite-(Y) ,crystal structure ,single crystal X-ray diffraction ,Mount Cervandone - Published
- 2008
10. Crystal-chemical relationships between beta-fergusonite-(Y) and related phases from Mount Cervandone and genetic implications
- Author
-
Guastoni, A, CAMARA ARTIGAS, Fernando, and Nestola, F.
- Subjects
crystal structure ,beta-fergusonite-(Y) ,single crystal X-ray diffraction - Published
- 2008
11. The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: the I1 - I2/c and I2/c - P21/c phase transitions
- Author
-
Benna, Piera, Nestola, F., BOFFA BALLARAN, T., BALIC ZUNIC, T., FAHL LUNDEGAARD, L., and Bruno, Emiliano
- Subjects
phase transition ,Crystal structure ,high-pressure studies ,XRD data - Published
- 2007
12. Eckerite, Ag2CuAsS3, a new Cu-bearing sulfosalt from Lengenbach quarry, Binn valley, Switzerland: description and crystal structure.
- Author
-
Bindi, L., Nestola, F., Graeser, S., Tropper, P., and Raber, T.
- Subjects
- *
GOLD mining , *MINERAL nomenclature , *MINERALOGY , *CRYSTAL structure , *CRYSTALLOGRAPHY , *MINES & mineral resources , *MINERAL industries - Abstract
Eckerite, ideally Ag2CuAsS3, is a new mineral from the Lengenbach quarry in the Binn Valley, Valais, Switzerland. It occurs as very rare euhedral crystals up to 300 mm across associated with realgar, sinnerite, hatchite, trechmannite and yellow, fibrous smithite. In thick section eckerite is opaque with a metallic lustre and shows a dark orange-red streak. It is brittle; the Vickers hardness (VHN25) is 70 kg/mm2 (range: 64-78) (Mohs hardness of ~2½-3). In reflected light, eckerite is moderately bireflectant and weakly pleochroic from light grey to a slightly bluish grey. Internal reflections are absent. Under crossed nicols, it is weakly anisotropic with greyish to light blue rotation tints. Reflectance percentages for Rmin and Rmax are 27.6, 31.7 (471.1 nm), 22.8, 26.1 (548.3 nm), 21.5, 24.5 (586.6 nm) and 19.4, 22.3 (652.3 nm), respectively. Eckerite is monoclinic, space group C2/c, with a = 11.8643(3), b = 6.2338(1), c = 16.6785(4) Å , β = 110.842(3)º, V = 1152.81(5) Å3, Z = 8. The crystal structure [R1 = 0.0769 for 1606 reflections with Fo > 4σ(Fo)] is topologically identical to that of xanthoconite and pyrostilpnite. In the structure, AsS3 pyramids are joined by AgS3 triangles to form double sheets parallel to (001); the sheets are linked by Cu(Ag) atoms in a quasi-tetrahedral coordination. Among the three metals sites, Ag2 is dominated by Cu. The mean metal-S distances reflect well the Ag ↔ Cu substitution occurring at this site. The eight strongest powder X-ray diffraction lines [d in Å (I/I0) (hkl)] are: 3.336 (70) (3̅12); 2.941 (100) (3̅14,114); 2.776 (80) (400,2̅06); 2.677 (40) (312); 2.134 (50) (4̅21); 2.084 (40) (2̅08,206); 2.076 (40) (420); 1.738 (40) (2̅28,226). A mean of five electron microprobe analyses gave Ag 52.08(16), Cu 11.18(9), Pb 0.04(1), Sb 0.29(3), As 15.28(11), S 20.73(13), total 99.60 wt.%, corresponding, on the basis of a total of 7 atoms per formula unit, to Ag2.24Cu0.82As0.94Sb0.01S2.99. The new mineral has been approved by the International Mineralogical Association Commission on New Minerals, Nomenclature and Classification (2014-063) and named for Markus Ecker, a well known mineral expert on the Lengenbach minerals for more than 25 years. [ABSTRACT FROM AUTHOR]
- Published
- 2015
- Full Text
- View/download PDF
13. The alunite supergroup under high pressure: the case of natrojarosite, NaFe3(SO4)2(OH)6.
- Author
-
NESTOLA, F., MILLS, S. J., PERIOTTO, B., and SCANDOLO, L.
- Subjects
- *
SULFATE minerals , *ALUNITE , *FORCE density , *MINERALS , *CRYSTALS - Abstract
A single crystal of natrojarosite, NaFe3(SO4)2(OH)6, was investigated by single-crystal X-ray diffraction at high-pressure conditions (up to 8.8 GPa) using a diamond-anvil cell. The unit-cell parameters were determined at 11 different pressures and no indications of a phase transition were found up to the maximum pressure reached. The volume and axial moduli were fitted to a third-order Birch-Murnaghan equation-of-state which gave the following values: V0 = 769.6(2) Å3, KT0 = 50.6(9) GPa, K' = 9.9(4); a = 7.3172(6) Å, KT' = 104(2), K' = 7.6(9); c = 16.5965(20) Å, KT0 = 24.6(4) and K' = 7.1(2). The crystal structure of natrojarosite was refined at seven different pressures up to 8.779(11) GPa [a = 7.3170(4), c = 16.5955(5) Å and V = 769.46(9) Å 3 in R3m at 0.00010(1) GPa and a = 7.1594(8), c = 15.6003(17) Å and V = 692.49(8) Å 3 at 8.779(11) GPa]. The structural analysis shows that the 12-fold Na polyhedron accommodates most of the deformation by a large volume decrease (14%) and strong polyhedral distortion (63%). Our results indicate that natrojarosite has the most compressible structure of the supergroup studied sofar, and has a very strong axial anisotropy. [ABSTRACT FROM AUTHOR]
- Published
- 2013
- Full Text
- View/download PDF
14. Manganoblödite, Na2Mn(SO4)2·4H2O, and cobaltoblödite, Na2Co(SO4)2·4H2O: two new members of the blödite group from the Blue Lizard mine, San Juan County, Utah, USA
- Author
-
Kasatkin, A. V., Nestola, F., Plášil, J., Marty, J., Belakovskiy, D. I., Agakhanov, A. A., Mills, S. J., Pedron, D., Lanza, A., Favaro, M., Bianchin, S., Lykova, I. S., Goliáš, V., and Birch, W. D.
- Subjects
- *
CRYSTAL structure , *MINERALS , *CHEMICALS , *SULFATES , *REFRACTIVE index of minerals - Abstract
Two new minerals - manganoblödite (IMA2012-029), ideally Na2Mn(SO4)2·4H2O, and cobaltoblödite (IMA2012-059), ideally Na2Co(SO4)2·4H2O, the Mn-dominant and Co-dominant analogues of blödite, respectively, were found at the Blue Lizard mine, San Juan County, Utah, USA. They are closely associated with blödite (Mn-Co-Ni-bearing), chalcanthite, gypsum, sideronatrite, johannite, quartz and feldspar. Both new minerals occur as aggregates of anhedral grains up to 60 μm (manganoblödite) and 200 μm (cobaltoblödite) forming thin crusts covering areas up to 2 × 2 cm on the surface of other sulfates. Both new species often occur as intimate intergrowths with each other and also with Mn-Co-Ni-bearing blödite. Manganoblödite and cobaltoblödite are transparent, colourless in single grains and reddish-pink in aggregates and crusts, with a white streak and vitreous lustre. Their Mohs' hardness is ~2½. They are brittle, have uneven fracture and no obvious parting or cleavage. The measured and calculated densities are Dmeas = 2.25(2) g cm−3 and Dcalc = 2.338 g cm−3 for manganoblödite and Dmeas = 2.29(2) g cm−3 and Dcalc = 2.347 g cm−3 for cobaltoblödite. Optically both species are biaxial negative. The mean refractive indices are α = 1.493(2), β = 1.498(2) and γ = 1.501(2) for manganoblödite and α = 1.498(2), β = 1.503(2) and γ = 1.505(2) for cobaltoblödite. The chemical composition of manganoblödite (wt.%, electron-microprobe data) is: Na2O 16.94, MgO 3.29, MnO 8.80, CoO 2.96, NiO 1.34, SO3 45.39, H2O (calc.) 20.14, total 98.86. The empirical formula, calculated on the basis of 12 O a.p.f.u., is: Na1.96(Mn0.44Mg0.29Co0.14Ni0.06)Σ0.93S2.03O8·4H2O. The chemical composition of cobaltoblödite (wt.%, electron-microprobe data) is: Na2O 17.00, MgO 3.42, MnO 3.38, CoO 7.52, NiO 2.53, SO3 45.41, H2O (calc.) 20.20, total 99.46. The empirical formula, calculated on the basis of 12 O a.p.f.u., is: Na1.96(Co0.36Mg0.30Mn0.17Ni0.12)Σ 0.95S2.02O8·4H2O. Both minerals are monoclinic, space group P21/a, with a = 11.137(2), b = 8.279(1), c = 5.5381(9) Å, β = 100.42(1)°, V = 502.20(14) Å3 and Z = 2 (manganoblödite); and a = 11.147(1), b = 8.268(1), C = 5.5396(7) Å, β = 100.517(11)°, V = 501.97(10) Å3 and Z = 2 (cobaltoblödite). The strongest diffractions from X-ray powder pattern [listed as (d,Å(I)(hkl)] are for manganoblödite: 4.556(70)(210, 011); 4.266(45)(2̅01); 3.791(26)(2̅11); 3.338(21)(310); 3.291(100)(220, 021), 3.256(67)(211,1̅21), 2.968(22)(2̅21), 2.647(24)(4̅01); for cobaltoblödite: 4.551(80)(210, 011); 4.269(50)(2̅01); 3.795(18)(2̅11); 3.339(43)(310); 3.29(100)(220, 021), 3.258(58)(211, 1̅21), 2.644(21)( 4̅01), 2.296(22)( 1̅22). The crystal structures of both minerals were refined by single-crystal X-ray diffraction to R1 = 0.0459 (manganoblödite) and R1 = 0.0339 (cobaltoblödite). [ABSTRACT FROM AUTHOR]
- Published
- 2013
- Full Text
- View/download PDF
15. New milarite/osumilite-type phase formed during ancient glazing of an Egyptian scarab.
- Author
-
Artioli, G., Angelini, I., and Nestola, F.
- Subjects
SCARABS (Amulets) ,ARCHAEOLOGICAL excavations ,SINGLE crystals ,X-ray diffraction ,CRYSTAL structure ,SOAPSTONE ,TEMPERATURE effect - Abstract
A scarab found in grave 25 of the Monte Prama necropolis, near Cabras, Oristano, Sardinia, is of special importance for the archaeological interpretation and dating of this important archaeological site. The object has been misinterpreted in the past as composed by bone: recent archaeometric analyses showed that it is a glazed steatite of Egyptian origin and that the altered surface contains interesting phases crystallized during the high-temperature interaction of the Mg-rich talc core with the alkali-rich glass used for glazing. A novel single crystal X-ray diffraction analysis of one of the phases indicates that it is a new compound having the milarite-osumilite structure type, with a peculiar composition close to (NaK□)(Mg)(MgCuFe)(SiAl)O, not reported for naturally occurring minerals. The structural and crystal chemical features of the compound, together with the known high-temperature stability of the series, allow a complete interpretation of the glazing process and conditions, based on direct application of the glaze on the steatite core with subsequent treatment at temperatures above 1000 °C. [ABSTRACT FROM AUTHOR]
- Published
- 2013
- Full Text
- View/download PDF
16. Compressibility of NaMnSi2O6: The role of electronic isovalency for the validity of bulk-modulus–volume relationship
- Author
-
Nestola, F., Nardini, L., Pasqual, D., Periotto, B., Lucchetti, G., Miletich, R., and Belmonte, D.
- Subjects
- *
SODIUM compounds , *ELECTRONIC structure , *PYROXENE , *X-ray diffraction , *CRYSTAL structure , *OXIDATION - Abstract
Abstract: A natural crystal with NaMnSi2O6 composition (space group C2/c) belonging to the family of clinopyroxene structures was investigated by in-situ high-pressure single-crystal X-ray diffraction up to 9 GPa in order to verify if the compressibility can be predicted from the unit-cell volume V 0 at 1 bar applying an established volume–compressibility relationship. Together with data for isostructural analogue phases the equation-of-state parameters of NaMnSi2O6 showed that such simplified relationship can not be longer applied. The findings demonstrate that prediction models for isostructural series are consistent not only for the aspect of structural isotopy, and valid relationships presuppose similar character of the electronic structure. In case of pyroxenes containing transition elements the established relationship is only valid for series of compounds with cations of identical oxidation state according to isovalent electronic character. [Copyright &y& Elsevier]
- Published
- 2012
- Full Text
- View/download PDF
17. High-pressure behavior of NaInSi2O6 and the influence of Me3+ on the compressibility of NaMe3+Si2O6 silicates
- Author
-
Periotto, B., Nestola, F., Balić-Žunić, T., Pasqual, D., Alvaro, M., and Ohashi, H.
- Subjects
- *
SILICATES , *COMPRESSIBILITY , *X-ray diffraction , *DIAMOND anvil cell , *EQUATIONS of state , *PYROXENE , *CRYSTAL structure - Abstract
Abstract: The equation of state of a single-crystal synthetic silicate NaInSi2O6 was determined from the unit cell parameters measured by X-ray diffraction using a diamond-anvil cell at 12 different pressures up to 7.83(1) GPa in order to provide a definitive model capable of predicting the high-pressure behavior of NaMe3 +Si2O6 silicate compounds. The data were fitted by a third-order Birch–Murnaghan equation of state obtaining the following coefficients: , . Our results show similar results for NaMe3 +Si2O6 compounds and confirm that for this mineral family, the empirical relationship proposed in previous investigations is valid for isostructural compounds only if they share the same valence electron character. In addition, we collected intensity data on the same compound at 16 different pressures up to 9.467 GPa using a diamond-anvil cell with diamond backing plates. The main structural compression mechanism is played by the tetrahedral chain kinking, which is related to the shortening of Na–O3long distances. Comparing our equation of state and high-pressure crystal structural results with previous data on NaMe3 +Si2O6 pyroxenes, we show that their compressibility increases much faster with the size of Me3 + cation when this one is a 3d transition metal. [Copyright &y& Elsevier]
- Published
- 2012
- Full Text
- View/download PDF
18. The effect of the hedenbergitic substitution on the compressibility of jadeite.
- Author
-
Nestola, F., Ballaran, T. Boffa, Liebske, C., Thompson, R., and Downs, R. T.
- Subjects
- *
JADEITE (Petrology) , *GEMS & precious stones , *ANISOTROPY , *DIAMONDS , *ANIONS , *PROPERTIES of matter , *SOLID solutions , *X-ray diffraction , *PHASE transitions - Abstract
Four synthetic crystals belonging to the jadeite (Jd, NaAlSi2O6)-hedenbergite (Hd, CaFeSi2O6) solid solution were investigated by X-ray diffraction in situ at high pressure using a diamond anvil cell to Pmax = 10.6 GPa. The samples exhibited space group symmetry C2/c throughout the investigated pressure range and did not show any phase transformations. V0, KT0, and K′ were simultaneously refined by fitting a third-order Birch-Murnaghan equation of state to pressure-volume data for all samples. The following relationship between bulk modulus and molar fraction of jadeite is observed: KT0 = 108.7(2) (GPa) + 0.191(9) × [% molar Jd] + 0.0006(1) × [% molar Jd]2 The bulk modulus of hedenbergite is 19% lower than jadeite with a strong axial anisotropy that increases with increasing the Hd content. In particular, the compressibility along the b axis (the most compressible in pyroxenes) increases by about 35% going from Jd to Hd while along the c axis the increase in compressibility is about 24%. The a axis does not show any variation in the deformation rate along the join. The analysis of the crystal structure behavior with pressure for all samples clearly indicates that the main cause of the strong anisotropy on the b-c plane is related to the narrowing of the M1 octahedral chain and to anion-anion interactions increasing the packing efficiency of the anion skeletons of the crystals going from Jd to Hd. [ABSTRACT FROM AUTHOR]
- Published
- 2008
- Full Text
- View/download PDF
19. Low-temperature behavior of NaGaSi2O6.
- Author
-
Nestola, F., Rotiroti, N., Bruno, M., Tribaudino, M., Van Smaalen, S., Ohashi, H., and Redhammer, G. J.
- Subjects
- *
PYROXENE , *X-rays , *OPTICAL diffraction , *LOW temperatures , *ROCK-forming minerals - Abstract
Synthetic NaGaSi2O6-pyroxene, space group C2/c, was investigated at low temperature between 295 to 110 K by X-ray diffraction. The evolution of the unit-cell parameters as a function of temperature does not indicate any structural phase transition down to 110 K. Calculated values for the Debye temperature, θD, and the Grüneisen parameter, γ, are 653(39) and 0.84(8) K, respectively, close to those of other pyroxenes. Five complete intensity data collections were performed at 295, 235, 190, 145, and 110 K to investigate the temperature dependence of the crystal structure. The space group remains C2/c down to 110 K, but anomalies were found between 235 and 190 K for the temperature dependencies of the volume and strain of the M1 polyhedron. This anomalous behavior could be related to variations of the Ga-O2(C1,D1) bond length and the O1(A1,B1)-Ga-O2(C1,D1) bond angle. The C2/c-P1̅ phase transition observed in a previous work for NaTiSi2O6 at about 200 K did not occur for NaGaSi2O6 down to the minimum temperature investigated in this work. This is not due to the different ionic radius at M1 site or to a different tetrahedral chain extension between these two compositions but it is likely due to unfilled t2g orbitals, which do not exist in NaGaSi2O6. [ABSTRACT FROM AUTHOR]
- Published
- 2007
- Full Text
- View/download PDF
20. Low-temperature behavior of NaGaSi2O6.
- Author
-
Nestola, F., Rotiroti, N., Bruno, M., Tribaudino, M., Van Smaalen, S., Ohashi, H., and Redhammer, G. J.
- Subjects
PYROXENE ,X-rays ,OPTICAL diffraction ,LOW temperatures ,ROCK-forming minerals - Abstract
Synthetic NaGaSi
2 O6 -pyroxene, space group C2/c, was investigated at low temperature between 295 to 110 K by X-ray diffraction. The evolution of the unit-cell parameters as a function of temperature does not indicate any structural phase transition down to 110 K. Calculated values for the Debye temperature, θD , and the Grüneisen parameter, γ, are 653(39) and 0.84(8) K, respectively, close to those of other pyroxenes. Five complete intensity data collections were performed at 295, 235, 190, 145, and 110 K to investigate the temperature dependence of the crystal structure. The space group remains C2/c down to 110 K, but anomalies were found between 235 and 190 K for the temperature dependencies of the volume and strain of the M1 polyhedron. This anomalous behavior could be related to variations of the Ga-O2(C1,D1) bond length and the O1(A1,B1)-Ga-O2(C1,D1) bond angle. The C2/c-P1̅ phase transition observed in a previous work for NaTiSi2 O6 at about 200 K did not occur for NaGaSi2 O6 down to the minimum temperature investigated in this work. This is not due to the different ionic radius at M1 site or to a different tetrahedral chain extension between these two compositions but it is likely due to unfilled t2g orbitals, which do not exist in NaGaSi2 O6 . [ABSTRACT FROM AUTHOR]- Published
- 2007
- Full Text
- View/download PDF
21. Garnet, the archetypal cubic mineral, grows tetragonal.
- Author
-
Cesare, B., Nestola, F., Johnson, T., Mugnaioli, E., Della Ventura, G., Peruzzo, L., Bartoli, O., Viti, C., and Erickson, T.
- Subjects
- *
GARNET , *CRYSTAL structure , *SCHISTS , *THERMODYNAMICS , *GEOLOGY - Abstract
Garnet is the archetypal cubic mineral, occurring in a wide variety of rock types in Earth's crust and upper mantle. Owing to its prevalence, durability and compositional diversity, garnet is used to investigate a broad range of geological processes. Although birefringence is a characteristic feature of rare Ca–Fe3+ garnet and Ca-rich hydrous garnet, the optical anisotropy that has occasionally been documented in common (that is, anhydrous Ca–Fe2+–Mg–Mn) garnet is generally attributed to internal strain of the cubic structure. Here we show that common garnet with a non-cubic (tetragonal) crystal structure is much more widespread than previously thought, occurring in low-temperature, high-pressure metamorphosed basalts (blueschists) from subduction zones and in low-grade metamorphosed mudstones (phyllites and schists) from orogenic belts. Indeed, a non-cubic symmetry appears to be typical of common garnet that forms at low temperatures (<450 °C), where it has a characteristic Fe–Ca-rich composition with very low Mg contents. We propose that, in most cases, garnet does not initially grow cubic. Our discovery indicates that the crystal chemistry and thermodynamic properties of garnet at low-temperature need to be re-assessed, with potential consequences for the application of garnet as an investigative tool in a broad range of geological environments. [ABSTRACT FROM AUTHOR]
- Published
- 2019
- Full Text
- View/download PDF
22. Redetermination and new description of the crystal structure of vanthoffite, Na6Mg(SO4)4.
- Author
-
Balić-Žunić, T., Pamato, M. G., and Nestola, F.
- Subjects
- *
CRYSTAL structure , *TETRAHEDRA , *POLYHEDRA , *MINERALS , *SPACE groups , *DIMERS , *SULFATES - Abstract
The crystal structure of vanthoffite {hexasodium magnesium tetrakis[sulfate(VI)]}, Na6Mg(SO4)4, was solved in the year 1964 on a synthetic sample [Fischer & Hellner (1964). Acta Cryst. 17, 1613]. Here we report a redetermination of its crystal structure on a mineral sample with improved precision. It was refined in the space group P21/c from a crystal originating from Surtsey, Iceland. The unique Mg (site symmetry 1̅) and the two S atoms are in usual, only slightly distorted octahedral and tetrahedral coordinations, respectively. The three independent Na atoms are in a distorted octahedral coordination (1×) and distorted 7-coordinations intermediate between a `split octahedron' and a pentagonal bipyramid (2×). [MgO6] coordination polyhedra interchange with one half of the sulfate tetrahedra in <011> chains forming a (100) meshed layer, with dimers formed by edge-sharing [NaO7] polyhedra filling the interchain spaces. The other [NaO7] polyhedra are organized in a parallel layer formed by [010] and [001] chains united through edge sharing and bonds to the remaining half of sulfate groups and to [NaO6] octahedra. The two types of layers interconnect through tight bonding, which explains the lack of morphological characteristics typical of layered structures. [ABSTRACT FROM AUTHOR]
- Published
- 2020
- Full Text
- View/download PDF
23. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene.
- Author
-
Nestola, F., Ballaran, T. Boffa, Balić-Žunić, T., Secco, L., and Dal Negro, A.
- Subjects
- *
HIGH pressure (Science) , *ANISOTROPY , *CRYSTALLOGRAPHY , *X-ray diffraction , *PYROXENE , *ROCK-forming minerals - Abstract
A single crystal of a natural orthopyroxene with composition M2[Fe0.8182+Mg0.156Ca0.010Mn0.016]M1[Fe0.0812+ Mg0.767Al0.084Fe0.0683+]TA[Si]TB[Si0.848Al0.152]O6 and space group Pbca (sample S95) was investigated at high pressure by X-ray diffraction using a diamond-anvil cell up to 9.56 GPa. No phase transitions were detected in the pressure range investigated. The unit-cell parameters, a, b, and c, decrease non-linearly with pressure and show an axial compression anisotropy with a ratio βa:βb:βc = 1.00:1.64:1.16. The unit-cell volume decreases non-linearly as well and with a negative variation, by about 6.3% up to 9.56 GPa. The equation of state calculated using high-accuracy volume-pressure data up to 5.5 GPa gave the following coefficients: V0 = 846.02(4) ų, KT0 = 115.4(6) GPa, K' = 7.7(3). Among the Mg-orthopyroxenes investigated at high pressure so far S95 shows the highest bulk modulus. Six complete intensity data were collected at 0, 0.16, 1.72, 3.95, 8.03, and 9.56 GPa. The results confirm previous conclusions regarding the compressional mechanism in orthopyroxenes. At lower pressures, compression is mostly connected to a decrease in volume of the two M-coordination octahedra, accompanied by an increased kink in the B-tetrahedral chain. At higher pressures, compression of the M sites decreases, the kink of the tetrahedral chains stops to change, and reduction in unit-cell volume is accompanied mainly by compression of tetrahedra. This change in compressional trends results in a relatively large K' parameter and a pronounced stiffening of the structure with pressure. The presence of Al in the TB tetrahedral site influences the kink of the B tetrahedral chain, which depends on the ratio of sizes of the M2 and TB coordination polyhedra. The increased stiffness of the M polyhedra, caused by the presence of Fe, is the main reason for the high bulk modulus of S95 and its resistance to shortening of the c axis. This explains the limited shortening of the c axis in S95 and the different compressional axial anisotropy with respect to other orthopyroxenes investigated under high pressure. [ABSTRACT FROM AUTHOR]
- Published
- 2008
- Full Text
- View/download PDF
24. The real topological configuration of the extra-framework content in alkali-poor beryl: A multi-methodological study.
- Author
-
Gatta, G. Diego, Nestola, F., Bromiley, G. D., and Mattauch, S.
- Subjects
- *
BERYL , *LASER ablation , *MASS spectrometry , *OXYGEN , *ATOMS , *MOLECULES - Abstract
The crystal structure of alkali/water-poor beryl (H2O + Na2O + Cs2O < 1.2 wt%) was reinvestigated by means of laser ablation inductively coupled plasma mass spectroscopy, thermogravimetric analysis, neutron diffraction, and polarized infrared spectroscopy to determine the real topological configuration of the extra-framework content in the six-membered ring channels. Analysis of the nuclear density Fourier map suggests that the (water) oxygen is located along the sixfold axis at the 2a site (0,0,1/4), whereas the (water) protons are at -0.028(7), -0.071(3), 0.332(1). The hydrogen atoms are distributed in 6 x 2 equivalent positions, above and below the oxygen site. Geometrical configuration of the water molecule is well defined: the O-H bond distance is 0.949(18) Å and the H-O-H bond angle is 106.9(2.2)º. The H⋯H vector is oriented at ∼4° from [001]. This configuration is completely different from that found in alkali-rich beryl, where the H⋯H vector is perpendicular to [001]. Na is probably located, with the H2O oxygen, at the 2a site. According to the chemical analysis, which shows that the amounts of other alkali and earth-alkali cations are negligible (Rb, K, Mg, Mn ≤ 110 ppm, Ca ≤ 225 ppm, Cs ≤ 430 ppm), no effect of other cations on the extra-framework population was observed in the structural refinement. The final agreement index (R1) of the structural refinement was 0.037 for 34 refined parameters and 160 unique reflections with Fo 4σ(Fo). The topological configuration of the H2O molecule into the channel is confirmed by the spectroscopic investigation. Polarized single-crystal IR spectra show that the H2O molecule is oriented with the molecular symmetry axis perpendicular to the hexagonal axis and H⋯H vector parallel (or quasi-parallel) to [001]. [ABSTRACT FROM AUTHOR]
- Published
- 2006
- Full Text
- View/download PDF
25. Oxycalcioroméite, Ca2Sb2O6O, from Buca della Vena mine, Apuan Alps, Tuscany, Italy: a new member of the pyrochlore supergroup.
- Author
-
BIAGIONI, C., ORLANDI, P., NESTOLA, F., and BIANCHIN, S.
- Subjects
- *
ROCK-forming minerals , *OXIDE minerals , *DOLOMITE , *MOUNTAINS - Abstract
The new mineral species oxycalcioroméite, Ca2Sb5+2 O6O, has been discovered at the Buca della Vena mine, Stazzema, Apuan Alps, Tuscany, Italy. It occurs as euhedral octahedra, up to 0.1 mm in size, embedded in dolostone lenses in the baryte + pyrite + iron oxides ore. Associated minerals are calcite, cinnabar, derbylite, dolomite, hematite, 'mica', pyrite, sphalerite and 'tourmaline'. Oxycalcioroméite is reddish-brown in colour and transparent. It is isotropic, with ncalc = 1.950. Electron microprobe analysis gave (wt.%; n = 6) Sb2O5 63.73, TiO2 3.53, SnO2 0.28, Sb2O3 10.93, V2O3 0.68, Al2O3 0.28, PbO 0.68, FeO 5.52, MnO 0.13, CaO 13.68, Na2O 0.83, F 1.20, O = F - 0.51, total 100.96. No H2O, above the detection limit, was indicated by either infrared or micro-Raman spectroscopies. The empirical formula, based on 2 cations at the B site, is (Ca1.073Fe2+0.338Sb3+0.330Na0.118 Pb0.013Mn0.008)Σ=1.880(Sb5+ 1.734Ti0.194V0.040Al0.024Sn0.008)Σ=2.000(O6.682F0.278)Σ6.960. The crystal structure study gives a cubic unit cell, space group Fd3m, with a 10.3042(7) Å, V 1094.06(13) Å 3, Z = 8. The five strongest X-ray powder diffraction lines are [d (Å)I (visually estimated)(hkl)]: 3.105(m)(311); 2.977(s)(222); 2.576(m)(400); 1.824(ms)(440); and 1.556(ms)(622). The crystal structure of oxycalcioroméite has been solved by X-ray single-crystal study on the basis of 114 observed reflections, with a final R1 = 0.0114. It agrees with the general features of the members of the pyrochlore supergroup. [ABSTRACT FROM AUTHOR]
- Published
- 2013
- Full Text
- View/download PDF
26. High-pressure crystal structure investigation of synthetic Fe2SiO4 spinel
- Author
-
Monika Koch-Müller, Francesco Princivalle, Tonči Balić-Žunić, L. Secco, A. Dal Negro, Filippo Parisi, Fabrizio Nestola, Nestola, F, Balic-Zunic, T, Koch-Mueller, M, Secco, L, Princivalle, F, Parisi, F, Dal Negro, A, Nestola, F., Balic Zunic, T., Koch Muller, M., Secco, L., Princivalle, Francesco, Parisi, Filippo, and Dal Negro, A.
- Subjects
Materials science ,high pressure ,X-ray diffraction ,single crystal ,synthetic Fe2SiO4 spinel ,010504 meteorology & atmospheric sciences ,high pressure, X-ray diffraction, single crystal, synthetic Fe2SiO4 spinel ,X ray diffraction ,Spinel ,550 - Earth sciences ,Crystal structure ,engineering.material ,01 natural sciences ,Crystallography ,Ringwoodite ,Octahedron ,Geochemistry and Petrology ,X-ray crystallography ,engineering ,Tetrahedron ,Single crystal ,0105 earth and related environmental sciences ,Solid solution - Abstract
The crystal structure of Fe2SiO4 spinel at room temperature was investigated at seven different pressures by X-ray diffraction, using a diamond anvil cell to examine the influence of Fe substitution on ringwoodite behaviour at high pressure. The results compared with those of a pure Mg endmember show that the substitution of Fe into the spinel structure causes only small changes in the compression rate of coordination polyhedra and the distortion of the octahedron. The data show that the compression rate for the octahedron and tetrahedron in (Mg,Fe)2SiO4 can be considered statistically equal for FeO6 and MgO6, as well as for SiO4 in both the endmembers. This shows why almost identical bulk moduli are reported along the solid solution in recent literature.
- Published
- 2011
27. As-bearing new mineral species from Valletta mine, Maira Valley, Piedmont, Italy: III. Canosioite, Ba2Fe3+(AsO4)2(OH), description and crystal structure.
- Author
-
Cámara, F., Bittarello, E., Ciriotti, M. E., Nestola, F., Radica, F., Massimi, F., Balestra, C., and Bracco, R.
- Subjects
- *
MUSCOVITE , *MONOCLINIC crystal system , *LUSTER , *BEARINGS (Machinery) - Abstract
The newmineral species canosioite, ideally Ba2Fe3+(AsO4)2(OH), has been discovered in the dump of Valletta mine, Maira Valley, Cuneo Province, Piedmont, Italy. Its origin is probably related to the reaction between ore minerals and hydrothermal fluids. It occurs in reddish-brown granules, subhedralmillimetre-size crystals,with a pale yellow streak and vitreous lustre. Canosioite is associated with aegirine, baryte, calcite, hematite, bronze Mn-bearing muscovite, unidentified Mn oxides and unidentified arsenates. Canosioite is biaxial (+) with a 2Vmeas = 84(2)°. It is weakly pleochroic with X = brownish yellow, Y = brown, Z = reddish brown, Z > Y > X. Canosioite is monoclinic, P21/m, with a = 7.8642(4), b = 6.1083(3), c = 9.1670(5) Å, β = 112.874(6)°, V = 405.73(4) Å3 and Z = 2. Calculated density is 4.943 g cm-3. The seven strongest diffraction lines of the observed powder X-ray diffraction pattern are [d in Å, (I) (hkl)]: 3.713 (18)(111̄), 3.304 (100)(211̄), 3.058 (31)(020), 3.047 (59)(103̄), 2.801 (73)(112), 2.337 (24)(220), 2.158 (24)(123̄). Electron microprobe analyses gave (wt.%): Na2O 0.06, MgO 0.43, CaO 0.02, NiO 0.02, CuO 0.03, SrO 0.42, BaO 49.36, PbO 1.69, Al2O3 1.25,Mn2O3 3.89, Fe2O3 6.95, Sb2O3 0.01, SiO2 0.03, P2O5 0.02,V2O5 10.88, As2O5 24.64, SO3 0.01, F 0.02, H2O 1.61 was calculated on the basis of 1 (OH,F,H2O) group per formula unit. Infrared spectroscopy confirmed the presence of OH. The empirical formula calculated on the basis of 9 O apfu, is (Ba1.92Pb0.05Sr0.02Na0.01)∑2.00(Fe3+0.52Mn3+0.29Al0.15Mg0.06)Σ1.02[(As0.64V0.36)Σ1.00O4]2[(OH0.92F0.01)(H2O)0.07] and the ideal formula is Ba2Fe3+(AsO4)2(OH). The crystal structure was solved by direct methods and found to be isostructural to that of arsenbrackebuschite. The structure model was refined (R1 = 2.6%) on the basis of 1245 observed reflections. Canosioite is named after the small municipality of Canosio, where the type locality, the Valletta mine, is situated. The new mineral and name were approved by the International Mineralogical Association Commission on New Minerals and Mineral Names (IMA2015-030). [ABSTRACT FROM AUTHOR]
- Published
- 2017
- Full Text
- View/download PDF
28. In situ analysis of garnet inclusion in diamond using single-crystal X-ray diffraction and X-ray micro-tomography
- Author
-
Marcello Merli, Fabrizio Nestola, Maya G. Kopylova, Luca Ziberna, Matteo Parisatto, Micaela Longo, Murli H. Manghnani, Andrea De Stefano, Paolo Nimis, Nestola, Fabrizio, M., Merli, Nimis, Paolo, Parisatto, Matteo, M., Kopylova, A., De, Longo, Micaela, Ziberna, Luca, M., Manghnani, Nestola, F, Merli, M, Nimis, P, Parisatto, M, Kopylova, M, Stefano, A, De Longo, M, Ziberna, L, and Manghnani, M
- Subjects
Diffraction ,diamond , garnet , inclusion , residual pressure , x-ray diffraction , x-ray micro-tomography , jericho kimberlite ,Analytical chemistry ,Mineralogy ,Crystal structure ,Jericho kimberlite ,engineering.material ,diamond ,Geochemistry and Petrology ,Inclusion ,Settore GEO/06 - Mineralogia ,X-ray ,Diamond ,garnet ,x-ray micro-tomography ,X-ray diffraction ,residual pressure ,x-ray microtomography ,X-ray crystallography ,engineering ,Inclusion (mineral) ,Single crystal ,Kimberlite ,Geology - Abstract
A single crystal of garnet enclosed in a diamond from the Jericho kimberlite (Slave Craton, Canada) has been investigated using X-ray diffraction and X-ray micro-tomography. The novel experimental approach allowed us to determine the crystal structure of the garnet. The unit-cell edge a and fractional atomic coordinates of oxygen were used to determine the composition via an updated Margules model for garnets. The composition is Pyr(0.41(5))Alm(0.36(7))Gro(0.22(1))Uva(0.01(1)), which is indistinguishable from the eclogitic garnets found in other Jericho diamonds. We also demonstrated that residual pressures on the inclusion of up to 1 GPa do not affect significantly the determination of the garnet composition by structure refinement.
- Published
- 2012
29. Effects of non-stoichiometry on the spinel structure at high pressure: Implications for Earth’s mantle mineralogy
- Author
-
Mauro Prencipe, Alberto Dal Negro, Fabrizio Nestola, Joseph R. Smyth, L. Secco, Francesco Princivalle, Matteo Parisatto, Marco Bruno, Nestola, F, SMYTH J., R, Parisatto, M, Secco, L, Princivalle, Francesco, Bruno, M, Prencipe, M, and DAL NEGRO, A.
- Subjects
Bulk modulus ,Materials science ,Olivine ,Spinel ,Mineralogy ,Crystal structure ,engineering.material ,Wadsleyite ,Mantle (geology) ,Ringwoodite ,Crystallography ,high pressure ,Geochemistry and Petrology ,Spinel Structure ,engineering ,non-stoichiometry ,Earth’s mantle mineralogy ,Stoichiometry - Abstract
A non-stoichiometric sample of spinel with composition T (Mg 0.4 Al 0.6 ) M (Al 1.8 □ 0.2 )O 4 was investigated by single-crystal X-ray diffraction in situ up to about 8.7 GPa using a diamond anvil cell. The P ( V ) data were fitted using a third-order Birch–Murnaghan equation of state and the unit-cell volume V 0 , the bulk modulus K T0 and its first pressure derivative K ′ were refined simultaneously providing the following coefficients: V 0 = 510.34(6) A 3 , K T0 = 171(2) GPa, K ′ = 7.3(6). This K T0 value represents the lowest ever found for spinel crystal structures. Comparing our data with a stoichiometric and natural MgAl 2 O 4 (pure composition) we observe a decrease in K T0 by about 11.5% and a strong increase in K ′ by about 33%. These results demonstrate how an excess of Al accompanied by the formation of significant cation vacancies at octahedral site strongly affects the thermodynamic properties of spinel structure. If we consider that the estimated mantle composition is characterized by 3–5% of Al 2 O 3 this could imply an Mg/Al substitution with possible formation of cation vacancies. The results of our study indicate that geodynamic models should take into account the potential effect of Mg/Al substitution on the incompressibility of the main mantle-forming minerals (olivine, wadsleyite, ringwoodite, Mg-perovskite).
- Published
- 2009
30. Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: The independency on the degree of cation order
- Author
-
Francesco Princivalle, Fabrizio Nestola, A. Dal Negro, L. Secco, T. Boffa Ballaran, Tonci Balic-Zunic, Nestola, F, BOFFA BALLARAN, T, BALIC ZUNIC, T, Princivalle, Francesco, and Secco, L. AND DAL NEGRO A.
- Subjects
Bulk modulus ,spinel ,Spinel ,Analytical chemistry ,chemistry.chemical_element ,X-ray single-crystal diffraction ,cation ordering ,high pressure ,Crystal structure ,engineering.material ,Oxygen ,Pressure range ,Crystallography ,Geophysics ,chemistry ,Geochemistry and Petrology ,engineering ,Compressibility ,X ray single crystal diffraction ,cataion ordering ,Pressure derivative ,Single crystal - Abstract
The equation of state and the crystal structure evolution with pressure were determined for two single crystals of pure natural MgAl 2 O 4 spinels with different degrees of order. The two samples studied were cut from a larger single crystal and one of them was experimentally disordered at high temperature. The two crystals, showing an inversion parameter x of 0.27 and 0.15 at ambient conditions, were loaded together in a diamond anvil cell and their unit-cell edge was measured up to about 7.5 GPa at 14 different pressures. The unit-cell volume, V 0 , the bulk modulus, K T0 , and its first pressure derivative, K ′, were simultaneously refined using a third-order Birch-Murnaghan equation of state, giving the following coefficients: V 0 = 529.32(2) A 3 , K T0 = 193(1) GPa, K ′ = 5.6(3) for the ordered sample and V 0 = 528.39(2) A 3 , K T0 = 192(1) GPa, K ′ = 5.4(3) for the disordered one. Complete intensity data were collected at 0, 0.44, 2.92, 7.34, and 8.03 GPa in a separate experiment. For the ordered and disordered samples the oxygen atomic coordinate u remains practically unchanged inside the investigated pressure range with an average value of 0.2633(5) and 0.2614(2), respectively. As a consequence, the polyhedral compressibilities are similar and are not influenced by the Mg/Al distribution over the two crystallographic sites. This also suggests that pressure has little or no influence on the degree of order in the MgAl 2 O 4 spinel.
- Published
- 2007
Catalog
Discovery Service for Jio Institute Digital Library
For full access to our library's resources, please sign in.