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Old Puzzle of Incommensurate Crystal Structure of Calaverite Aute2 And
Old puzzle of incommensurate crystal structure of calaverite AuTe2 and predicted stability of novel AuTe compound Sergey V. Streltsova,b,1, Valerii V. Roizenc, Alexey V. Ushakova, Artem R. Oganovc,d, and Daniel I. Khomskiie aDepartment of Theory of Low-Dimensional Spin Systems, Institute of Metal Physics, 620990 Yekaterinburg, Russia; bDepartment of Theoretical Physics and Applied Mathematics, Ural Federal University, 620002 Yekaterinburg, Russia; cComputational Materials Discovery Laboratory, Moscow Institute of Physics and Technology, 141701 Dolgoprudny, Moscow Region, Russian Federation; dMaterials Discovery Laboratory, Skolkovo Institute of Science and Technology, 143026 Skolkovo, Russian Federation; and eII. Physikalisches Institut, Universitat¨ zu Koln,¨ D-50937 Cologne, Germany Edited by James R. Chelikowsky, The University of Texas at Austin, Austin, Texas, and accepted by Editorial Board Member John D. Weeks August 14, 2018 (received for review February 15, 2018) Gold is a very inert element, which forms relatively few com- Old Puzzle of Calaverite’s Crystal Structure pounds. Among them is a unique material—mineral calaverite, AuTe2 has a distorted layered CdI2-type structure [the aver- AuTe2. Besides being the only compound in nature from which age structure has space group C 2=m (6)], with triangular layers one can extract gold on an industrial scale, it is a rare exam- of Au with Te atoms in between. However, there is a periodic ple of a natural mineral with incommensurate crystal structure. displacive modulation along the [010] direction, which makes Moreover, it is one of few systems based on Au, which become overall crystal structure incommensurate (7). The mechanism superconducting (at elevated pressure or doped by Pd and Pt). -
First-Principles Study of a Mos2-Pbs Van Der Waals Heterostructure Inspired by Naturally Occurring Merelaniite
materials Article First-Principles Study of a MoS2-PbS van der Waals Heterostructure Inspired by Naturally Occurring Merelaniite Gemechis D. Degaga, Sumandeep Kaur, Ravindra Pandey * and John A. Jaszczak Department of Physics, Michigan Technological University, Houghton, MI 49931, USA; [email protected] (G.D.D.); [email protected] (S.K.); [email protected] (J.A.J.) * Correspondence: [email protected] Abstract: Vertically stacked, layered van der Waals (vdW) heterostructures offer the possibility to design materials, within a range of chemistries and structures, to possess tailored properties. Inspired by the naturally occurring mineral merelaniite, this paper studies a vdW heterostructure composed of a MoS2 monolayer and a PbS bilayer, using density functional theory. A commensurate 2D heterostructure film and the corresponding 3D periodic bulk structure are compared. The results find such a heterostructure to be stable and possess p-type semiconducting characteristics. Due to the heterostructure’s weak interlayer bonding, its carrier mobility is essentially governed by the constituent layers; the hole mobility is governed by the PbS bilayer, whereas the electron mobility is governed by the MoS2 monolayer. Furthermore, we estimate the hole mobility to be relatively high (~106 cm2V−1s−1), which can be useful for ultra-fast devices at the nanoscale. Keywords: merelaniite; vdW heterostructure; MoS2; PbS; carrier mobility Citation: Degaga, G.D.; Kaur, S.; Pandey, R.; Jaszczak, J.A. First- 1. Introduction Principles Study of a MoS2-PbS van Two-dimensional (2D) materials are celebrated among the scientific community, due der Waals Heterostructure Inspired to the unparalleled exquisite properties compared to their bulk counterparts, arising from by Naturally Occurring Merelaniite. -
Inferred Phase Relations in Part of the System Au–Ag–Te: an Integrated Analytical Study of Gold Ore from the Golden Mile, Kalgoorlie, Australia
Mineralogy and Petrology (2005) 83: 283–293 DOI 10.1007/s00710-004-0065-1 Inferred phase relations in part of the system Au–Ag–Te: an integrated analytical study of gold ore from the Golden Mile, Kalgoorlie, Australia L. Bindi1, M. D. Rossell2, G. Van Tendeloo2, P. G. Spry3, and C. Cipriani1 1 Museo di Storia Naturale, Sezione di Mineralogia, Universita degli Studi di Firenze, Italy 2 Electron Microscopy for Materials Research (EMAT), University of Antwerp, Belgium 3 Department of Geological and Atmospheric Sciences, Iowa State University, Ames, IA, USA Received May 24, 2004; revised version accepted October 7, 2004 Published online December 7, 2004; # Springer-Verlag 2004 Editorial handling: J. G. Raith Summary Integrated X-ray powder diffraction, scanning electron microscopy, electron probe, and transmission electron microscopy studies have identified the rare contact assemblage calaverite–sylvanite–hessite in a sample of gold ore from the Golden Mile deposit, Kalgoorlie, Australia. The presence of coexisting calaverite–hessite at Kalgoorlie is a non-equilibrium assemblage whereby the stable hessite-bearing assemblage is hessite– sylvanite, which formed from the breakdown of the -phase or -phase below 120 C, stuutzite€ þ -phase, or sylvanite þ stuutzite€ þ -phase, as predicted by Cabri (1965). Introduction Epizonal and mesozonal gold and gold–silver telluride deposits spatially asso- ciated with calc-alkaline, alkaline, and mafic igneous rocks are among the largest resources of gold in the world. They include Golden Mile, Kalgoorlie, Australia (e.g., Clout et al., 1990; Shackleton et al., 2003), Emperor, Fiji (e.g., Ahmad et al., 1987; Pals and Spry, 2003), Cripple Creek, Colorado (e.g. -
Minerals of the San Luis Valley and Adjacent Areas of Colorado Charles F
New Mexico Geological Society Downloaded from: http://nmgs.nmt.edu/publications/guidebooks/22 Minerals of the San Luis Valley and adjacent areas of Colorado Charles F. Bauer, 1971, pp. 231-234 in: San Luis Basin (Colorado), James, H. L.; [ed.], New Mexico Geological Society 22nd Annual Fall Field Conference Guidebook, 340 p. This is one of many related papers that were included in the 1971 NMGS Fall Field Conference Guidebook. Annual NMGS Fall Field Conference Guidebooks Every fall since 1950, the New Mexico Geological Society (NMGS) has held an annual Fall Field Conference that explores some region of New Mexico (or surrounding states). Always well attended, these conferences provide a guidebook to participants. Besides detailed road logs, the guidebooks contain many well written, edited, and peer-reviewed geoscience papers. These books have set the national standard for geologic guidebooks and are an essential geologic reference for anyone working in or around New Mexico. Free Downloads NMGS has decided to make peer-reviewed papers from our Fall Field Conference guidebooks available for free download. Non-members will have access to guidebook papers two years after publication. Members have access to all papers. This is in keeping with our mission of promoting interest, research, and cooperation regarding geology in New Mexico. However, guidebook sales represent a significant proportion of our operating budget. Therefore, only research papers are available for download. Road logs, mini-papers, maps, stratigraphic charts, and other selected content are available only in the printed guidebooks. Copyright Information Publications of the New Mexico Geological Society, printed and electronic, are protected by the copyright laws of the United States. -
Koritnigite Zn(Aso3oh)•
Koritnigite Zn(AsO3OH) • H2O c 2001-2005 Mineral Data Publishing, version 1 Crystal Data: Triclinic, pseudomonoclinic. Point Group: 1. As imperfect platy crystals, to 5 mm, in aggregates. Physical Properties: Cleavage: {010}, perfect; cleavage traces k [001] and k [100], visible on {010}. Tenacity: Flexible. Hardness = 2 D(meas.) = 3.54 D(calc.) = 3.56 Optical Properties: Transparent. Color: Colorless, white, rose. Luster: Pearly on {010}. Optical Class: Biaxial (+). Orientation: X = b; Y ∧ a ' 28◦; Z ∧ c ' 22◦. α = 1.632(5) β = 1.652(3) γ = 1.693(3) 2V(meas.) = 70(5)◦ Cell Data: Space Group: P 1. a = 7.948(2) b = 15.829(5) c = 6.668(2) α =90.86(2)◦ β =96.56(2)◦ γ =90.05(2)◦ Z=8 X-ray Powder Pattern: Tsumeb, Namibia; very close to cobaltkoritnigite. 7.90 (10), 3.16 (9), 3.83 (7), 2.461 (6), 2.186 (5), 3.95 (4), 2.926 (4) Chemistry: (1) (2) (3) As2O5 51.75 54.67 51.46 FeO + Fe2O3 trace 0.05 CoO 4.54 NiO 2.44 ZnO 35.97 25.83 36.44 MgO trace H2O [12.3] [12.47] 12.10 Total [100.0] [100.00] 100.00 2− (1) Tsumeb, Namibia; by electron microprobe, (AsO3OH) confirmed by IR, H2O by difference. • (2) J´achymov, Czech Republic; H2O by difference. (3) Zn(AsO3OH) H2O. Occurrence: A secondary mineral of the lower oxidation zone in a dolostone-hosted polymetallic hydrothermal ore deposit (Tsumeb, Namibia). Association: Tennantite, cuprian adamite, stranskiite, lavendulan, k¨ottigite,tsumcorite, prosperite, o’danielite (Tsumeb, Namibia); erythrite, arsenolite, sphalerite (J´achymov, Czech Republic). -
Note on Lavendulan from Joachimstal, Bohemia
TOURNAL XIINERALOG}CAL SOCIET'Y OF A]IERICA 29 NOTE ON LAVENDULAN FROM JOACHIMSTAL, BOHEMIA \Vrrrrnu F. Fosnac,l Llnited, Stotes National Museu,m Under the name lavendulan, Breithaupt2 described a mineral from Annaberg in the Erzgebirge' The mineral formed thin crusts of a lavender blue color and botryoidal structure. Sufficient material apparently was not available for a quantitative analysis but the blowpipe characteristics were determined by Plattner' The collection of Colonel Washington A. Roebling contains a specimen of lavendulan from Joachimstal which probably repre- sents the same mineral described by Breithaupt. It is entirely similar in general appearances and blowpipe characteristics to the Annaberg material. The lavendulan forms very thin crusts with botryoidal surlace upon a seam of qvartz in a mica schist. Its color is patent blue (Ridgeway) with a vitreous to waxy lustre. Although the crust appears amorphous, under the microscopeit is seento be made up of minute radiated fibers or plates. They are slightly pleochroic, the colors being patent to oxide blue. The plates are so small that the optical properties could not be determined with exactness' The followingconstants were measured: B: 1'715+ 005;t: l'725+003' Z is in the direction of the length of the fibers. The extinction is inclined to the length of the fibers. The mineral is distinctly made up of bands of varying composition and the indices of refraction show a corresponding variation. Breithaupt's mineral was essentially a hydrous cobalt arsenate with some copper and nickel. Before the blowpipe the mineral colored the flame light blue (arsenic) and fused easily to a mass that assumedcrystalline form upon cooling. -
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American Mineralogist, Volume 77, pages 670475, 1992 NEW MINERAL NAMES* JonN L. J,Annson CANMET, 555 Booth Street,Ottawa, Ontario KIA OGl' Canada Abswurmbachite* rutile, hollandite, and manganoan cuprian clinochlore. The new name is for Irmgard Abs-Wurmbach, in recog- T. Reinecke,E. Tillmanns, H.-J. Bernhardt (1991)Abs- her contribution to the crystal chemistry, sta- wurmbachite, Cu'?*Mnl*[O8/SiOo],a new mineral of nition of physical properties ofbraunite. Type the braunite group: Natural occurrence,synthesis, and bility relations, and crystal structure.Neues Jahrb. Mineral. Abh., 163,ll7- material is in the Smithsonian Institution, Washington, r43. DC, and in the Institut fiir Mineralogie, Ruhr-Universitlit Bochum, Germany. J.L.J. The new mineral and cuprian braunit€ occur in brown- ish red piemontite-sursassitequartzites at Mount Ochi, near Karystos, Evvia, Greece, and in similar quartzites on the Vasilikon mountains near Apikia, Andros Island, Barstowite* Greece.An electron microprobe analysis (Andros mate- C.J. Stanley,G.C. Jones,A.D. Hart (1991) Barstowite, gave SiO, 9.8, TiO, rial; one of six for both localities) 3PbClr'PbCOr'HrO, a new mineral from BoundsClifl 0.61,Al,O3 0.60, Fe'O, 3.0,MnrO. 71.3,MgO 0.04,CuO St. Endellion,Cornwall. Mineral. Mag., 55, l2l-125. 12.5, sum 97.85 wto/o,corresponding to (CuStrMn3tu- Electron microprobe and CHN analysis gavePb75.47, Mgoo,)", oo(Mn3jrFe|jrAlo orTif.[nCuStr)", nrSi' o, for eight (calc.)6.03, sum 101.46wto/o, cations,ideally CuMnuSiO'r, the Cu analogueof braunite. Cl 18.67,C l.Iz,H 0.18,O to Pb.orClrrrCr.or- The range of Cu2* substitution for Mn2' is 0-42 molo/oin which for 17 atoms corresponds The min- cuprian braunite and 52-93 molo/oin abswurmbachite. -
New Minerals Approved Bythe Ima Commission on New
NEW MINERALS APPROVED BY THE IMA COMMISSION ON NEW MINERALS AND MINERAL NAMES ALLABOGDANITE, (Fe,Ni)l Allabogdanite, a mineral dimorphous with barringerite, was discovered in the Onello iron meteorite (Ni-rich ataxite) found in 1997 in the alluvium of the Bol'shoy Dolguchan River, a tributary of the Onello River, Aldan River basin, South Yakutia (Republic of Sakha- Yakutia), Russia. The mineral occurs as light straw-yellow, with strong metallic luster, lamellar crystals up to 0.0 I x 0.1 x 0.4 rnrn, typically twinned, in plessite. Associated minerals are nickel phosphide, schreibersite, awaruite and graphite (Britvin e.a., 2002b). Name: in honour of Alia Nikolaevna BOG DAN OVA (1947-2004), Russian crys- tallographer, for her contribution to the study of new minerals; Geological Institute of Kola Science Center of Russian Academy of Sciences, Apatity. fMA No.: 2000-038. TS: PU 1/18632. ALLOCHALCOSELITE, Cu+Cu~+PbOZ(Se03)P5 Allochalcoselite was found in the fumarole products of the Second cinder cone, Northern Breakthrought of the Tolbachik Main Fracture Eruption (1975-1976), Tolbachik Volcano, Kamchatka, Russia. It occurs as transparent dark brown pris- matic crystals up to 0.1 mm long. Associated minerals are cotunnite, sofiite, ilin- skite, georgbokiite and burn site (Vergasova e.a., 2005). Name: for the chemical composition: presence of selenium and different oxidation states of copper, from the Greek aA.Ao~(different) and xaAxo~ (copper). fMA No.: 2004-025. TS: no reliable information. ALSAKHAROVITE-Zn, NaSrKZn(Ti,Nb)JSi401ZJz(0,OH)4·7HzO photo 1 Labuntsovite group Alsakharovite-Zn was discovered in the Pegmatite #45, Lepkhe-Nel'm MI. -
Mineralogy and Environmental Stability of Slags from the Tsumeb Smelter, Namibia
Applied Geochemistry 24 (2009) 1–15 Contents lists available at ScienceDirect Applied Geochemistry journal homepage: www.elsevier.com/locate/apgeochem Mineralogy and environmental stability of slags from the Tsumeb smelter, Namibia Vojteˇch Ettler a,*, Zdenek Johan b, Bohdan Krˇíbek c, Ondrˇej Šebek d, Martin Mihaljevicˇ a a Institute of Geochemistry, Mineralogy and Mineral Resources, Charles University, Albertov 6, 128 43 Prague 2, Czech Republic b Bureau des Recherches Géologiques et Minières (BRGM), av. Claude Guillemin, 45060 Orléans, cedex 2, France c Czech Geological Survey, Geologická 6, 152 00 Prague 5, Czech Republic d Laboratories of the Geological Institutes, Charles University, Albertov 6, 128 43 Prague 2, Czech Republic article info abstract Article history: Three types of smelting slags originating from historically different smelting technologies in the Tsumeb Received 27 June 2008 area (Namibia) were studied: (i) slags from processing of carbonate/oxide ore in a Cu–Pb smelter (1907– Accepted 22 October 2008 1948), (ii) slags from Cu and Pb smelting of sulphide ores (1963–1970) and (iii) granulated Cu smelting Available online 30 October 2008 slags (1980–2000). Bulk chemical analyses of slags were combined with detailed mineralogical investi- gation using X-ray diffraction analysis (XRD), scanning electron microscopy (SEM/EDS) and electron Editorial handling by R. Fuge microprobe (EPMA). The slags are significantly enriched in metals and metalloids: Pb (0.97–18.4 wt.%), Cu (0.49–12.2 wt.%), Zn (2.82–12.09 wt.%), Cd (12–6940 mg/kg), As (930–75,870 mg/kg) and Sb (67– 2175 mg/kg). Slags from the oldest technology are composed of primary Ca- and Pb-bearing feldspars, spinels, complex Cu–Fe and Cu–Cr oxides, delafossite–mcconnellite phases and Ca–Pb arsenates. -
The Metallurgy of Antimony
Chemie der Erde 72 (2012) S4, 3–8 Contents lists available at SciVerse ScienceDirect Chemie der Erde journal homepage: www.elsevier.de/chemer The metallurgy of antimony Corby G. Anderson ∗ Kroll Institute for Extractive Metallurgy, George S. Ansell Department of Metallurgical and Materials Engineering, Colorado School of Mines, Golden, CO 80401, United States article info abstract Article history: Globally, the primary production of antimony is now isolated to a few countries and is dominated by Received 4 October 2011 China. As such it is currently deemed a critical and strategic material for modern society. The metallurgical Accepted 10 April 2012 principles utilized in antimony production are wide ranging. This paper will outline the mineral pro- cessing, pyrometallurgical, hydrometallurgical and electrometallurgical concepts used in the industrial Keywords: primary production of antimony. As well an overview of the occurrence, reserves, end uses, production, Antimony and quality will be provided. Stibnite © 2012 Elsevier GmbH. All rights reserved. Tetrahedrite Pyrometallurgy Hydrometallurgy Electrometallurgy Mineral processing Extractive metallurgy Production 1. Background bullets and armory. The start of mass production of automobiles gave a further boost to antimony, as it is a major constituent of Antimony is a silvery, white, brittle, crystalline solid that lead-acid batteries. The major use for antimony is now as a trioxide exhibits poor conductivity of electricity and heat. It has an atomic for flame-retardants. number of 51, an atomic weight of 122 and a density of 6.697 kg/m3 ◦ ◦ at 26 C. Antimony metal, also known as ‘regulus’, melts at 630 C 2. Occurrence and mineralogy and boils at 1380 ◦C. -
Toward the Crystal Structure of Nagyagite, [Pb(Pb,Sb)S2][(Au,Te)]
American Mineralogist, Volume 84, pages 669–676, 1999 Toward the crystal structure of nagyagite, [Pb(Pb,Sb)S2][(Au,Te)] HERTA EFFENBERGER,1,* WERNER H. PAAR,2 DAN TOPA,2 FRANZ J. CULETTO,3 AND GERALD GIESTER1 1Institut für Mineralogie und Kristallographie, Universität Wien, Althanstrasse 14, A-1090 Vienna, Austria 2Institut für Mineralogie, Universität Salzburg, Hellbrunnerstrasse 34, A-5020 Salzburg 3Kärntner Elektrizitäts AG, Arnulfplatz 2, A-9021 Klagenfurt, Austria ABSTRACT Synthetic nagyagite was grown from a melt as part of a search for materials with high-tempera- ture superconductivity. Electron microprobe analyses of synthetic nagyagite and of nagyagite from the type locality Nagyág, Transylvania (now S˘ac˘arîmb, Romania) agree with data from literature. The crystal chemical formula [Pb(Pb,Sb)S2][(Au,Te)] was derived from crystal structure investi- gations. Nagyagite is monoclinic pseudotetragonal. The average crystal structure was determined from both synthetic and natural samples and was refined from the synthetic material to R = 0.045 for 657 single-crystal X-ray data: space group P21/m, a = 4.220(1) Å, b = 4.176(1) Å, c = 15.119(3) Å, β = 95.42(3)°, and Z = 2. Nagyagite features a pronounced layer structure: slices of a two slabs thick SnS-archetype with formula Pb(Pb,Sb)S2 parallel to (001) have a thickness of 9.15 Å. Te and Au form a planar pseudo-square net that is sandwiched between the SnS-archetype layers; it is [4Te] assumed that planar Au Te4 configurations are edge connected to chains and that Te atoms are in a zigzag arrangement. -
Cylindrite: the Relation Between Its Cylindrical Shape and Modulated Structure
American Mineralogist, Volume 77, pages 758-764, 1992 Cylindrite: The relation between its cylindrical shape and modulated structure Su Wa.nc, PorBn R. Busrcr Departments of Geology and Chemistry, Arizona State University, Tempe, Arizona 85287, U.S.A. AnsrnLcr Cylindrite, a lead, tin, antimony, iron sulfosalt having a distinctive cylindrical mor- phology and a composite structure, is characterizedby incommensurate structural mod- ulations. It contains two types of sheets,and these have pseudohexagonal(H) and pseu- dotetragonal (T) structures with distinct lattice dimensions. The structure changes systematically from core to periphery of the crystals. The b and c axes of the H and T sheetsare almost parallel to each other near the crystal cores. Further from the cores the angular divergencebetween the axes of the two types of sheetsincreases (i.e., the sheets are increasingly rotated relative to one another), and the wavelength of the structural modulation decreases.The crystal accommodatesthe dimensional misfit between the H and T sheetsby a combination of this divergence,the variation of the structural modu- Iation, and the curving ofthe layers. INrnooucrroN exactly parallel to one another. The two types of sheets Crystals of almost all minerals form with flat faces,and are untrsual in that they have diferent structures and these faces characteristicallygrow at s tl as incommensurate dimensions par- another. Cylindrite belongs to a select ng. They stack along the a* direction in that typically displays an anomalous n HT. plied by its name, it forms in crystals Lc complications arise where crystals ders. Although highly unusual, tubul more units having diferent structures adoptedby a few other minerals, such€ llmann, I 968; Buseckand Veblen, 1988; 1967,1971;VeblenandBuseck,1979).