Über Strontioginorit,eine neue Ginorit-Varietdt aus dem Zechsteinsalz

Zusammenfassung Strontioginorit (Sr, Ca)₂B₁₄O₂₃ 8 H₂O mit Sr: Ca1,3:0,7 tritt in gut ausgebildeten Kristallen im Alteren Steinsalz von Reyershausen bei Göttingen auf. Es ergaben sich folgende Daten : ₀ = 12,85₀ Å,b ₀ = 14,48 Å,c ₀, = 12,85₅, Å, = 101° 35, RaumgruppeP 2_I/a,Z = 4, Dichte=2,25 gcm^–3,n = 1,512,n _/b = 1,524,n //[101] = 1,577.     

1Tc-Strontiohilgardit (Ca,Sr)2[B5O8(OH)2Cl] und seine Stellung in der Hilgarditgruppe X2/II[B5O8(OH)2Cl]

Zusammenfassung 1Tc-Strontiohilgardit (Ca, Sr)₂ [B₅O₈(OH)₂,Cl] mit Ca : Sr etwa 1 : 1 ist ein neues Mineral der Hilgarditgruppe. Fundpunkt: Reyersbausen (9° 59,7 E, 51° 36,6 N), Grube Königshall-Hindenburg, Flöz Staßfurt in sylvinitischer Ausbildung.Konstanten : triklin-pedial,a ₀=6,38 Å,b ₀=6,480 Å,c ₀=6,608 Å, =75,4°,=61,2°, =60,5°; tafelige-gestreckte Links- und Re chtskristalle, farblos, wasserunlöslich, piezoelektrisch. Härte 5–7, Dichte 2,99 g cm^–3;n =1,638,n =1,639,n =1,670; 2V =19°.Neue Daten für die Hilgarditgruppe : 2 M (Cc)-Calciumhilgardit (=Hilgardit) =4 Ca₂[B₅O₃(OH)₂Cl], Raumgruppe Cc.3Tc-Calciumhilgardit (=Parahilgardit) = 3 Ca₂[B₅O₃(OH)₂Cl]; trinklin-pedial, ₀=6,31 Å,b =6,484 Å,c ₀=17,50 Å; =84,0°,=79,6°, =60,9°.Die Polymorphiebeziehungen sind geometrisch deutbar durch eine spezielle Art der Polytropie (Stapelung von Links- und Rechtskristallen im Elementarbereich).     

Al-Si ordering in Sr-feldspar SrAl2Si2O8: IR,TEM and single-crystal XRD evidences

Al-Si ordering in Sr-feldspar has been followed by isothermal annealing, starting from a disordered metastable configuration. Ordering could not be followed by changes in the spontaneous strain as cell parameters did not show significant changes with thermal treatment from 0.016 h to 452 h at T=1350° C, while, on the contrary, significant changes in IR spectra are observed. A single crystal obtained from melt (Q _od 0) has been progressively heated up to 678 h at T=1350° C and the relevant structural refinements enabled to monitor changes in degree of Al-Si order up to Q_od = 0.86. In isothermal treatment for Sr-feldspar it is observed a significantly lower Q _od than in anorthite after the same annealing time. TEM observation has shown in Sr-feldspar, also for shortest annealing, b type reflections, while in anorthite, in the same conditions, e type reflections have been observed (Carpenter 1991a). In the first stages of ordering b APDs sized 100 Å (at T=1350° C, 0.33 h) have been observed in Sr-feldspar; APD coarsening occurs with an activation energy of 120±7 kcal mol^-1, not significantly different from anorthite. The ordering process seems to be a slower process in Sr-feldspar than in anorthite, even though data from longer annealing suggest that the Q _od close to the equilibrium is the same in Sr and Ca-feldspar (Q _od = 0.86 at T=1350° C).     

The crystal structure of trigonite,Pb3Mn(AsO3)2(AsO2OH)

Summary The mineral trigonite crystallizes in the monoclinic space groupPn–C _s ² witha ₀=7.26,b ₀=6.78,c ₀=11.09Å; =91.5°,Z=2. The structure was determined from 1250 X-ray intensities collected on an automatic two circle Weissenberg-type diffractometer. The final residual isR=6.5% using anisotropic temperature factors for Pb, Mn and As, and isotropic temperature factors for O.The structure consists of MnO₆ octahedra, sharing all six oxygens with arsenite groups to form a framework. The Pb atoms are attached to this framework with Pb–O distances2.23Å. One oxygen, bound only to an As atom, is interpreted as the donor for a hydrogen bond of 2.75Å.

---

Die Kristallstruktur des Trigonits, Pb₃Mn(AsO₃)₂(AsO₂OH)

Zusammenfassung Das Mineral Trigonit kristallisiert monoklin, RaumgruppePn–C _s ² ,a ₀=7,26,b ₀=6,78,c ₀=11,09Å; =91,5°;Z=2. Die Strukturermittlung erfolgte anhand von 1250 Röntgenintensitäten, die auf einem automatischen Zweikreis-Weissenbergdiffraktometer gesammelt wurden. Mit anisotropen Temperaturfaktoren für Pb, Mn und As sowie isotropen für die O-Atome ergibt sich einR-Wert von 6,5%.Die MnO₆-Oktaeder werden über die sechs Sauerstoffe mit Arsenitgruppen zu einem dreidimensionalen Gerüst verknüpft. Über Pb-O-Abstände2,23 Å sind die Pb-Atome in dieses Gerüst eingebaut. Ein Sauerstoff, nur an ein As-Atom gebunden, wird als Donator einer H-Brücke von 2,75 Å interpretiert.

---

---

With 2 Figures     

Kristallchemie natürlicher Telluride I: Verfeinerung der Kristallstruktur des Sylvanits,AuAgTe4

Zusammenfassung Mikrosondenanalysen und die Verfeinerung der Kristallstruktur zeigen, daß Sylvanit, AuAgTe₄, aus Baia de Arie (=Offenbánya), Rumänien, eine stöchiometrische Zusammensetzung und eine geordnete Kristallstruktur besitzt (a=8,95(1) Å,b=4,478(5) Å,c=14,62(2) Å; =145,35(5)°;Z=2; RaumgruppeP2/c–C _2h ⁴ ). Das Au-Atom ist von sechs Te-Atomen in einer für die Oxidationszahl III charakteristischen [4+2]-Koordination umgeben. Um das Ag-Atom (Oxidationszahl I) sind ebenfalls sechs Te-Atome, jedoch in einer [2+2+2]-Koordination, angeordnet. Über gemeinsame Kanten bauen AuTe₆- und AgTe₆-Polyeder Schichten parallel (100) auf. Diese Schichten werden über Te₂-Hanteln (Te–Te=2,82 Å) zu einem Gerüst verknüpft.

---

Crystal chemistry of natural tellurides. I: Refinement of the crystal structure of sylvanite, AuAgTe₄

Summary Electron microprobe analyses and the refinement of the crystal structure indicate, that sylvanite, AuAgTe₄, from Baia de Arie (=Offenbánya), Romania, has a stoichiometric composition and an ordered crystal structure (a=8.95(1) Å,b=4.478(5) Å,c=14.62(2) Å; =145.35(5)°;Z=2; space groupP2/c–C _2h ⁴ ). The Au atom is surrounded by six Te atoms in a [4+2] coordination as characteristic for oxidation state III. Around the Ag atom (oxidation state I) are also six Te atoms, but arranged in a [2+2+2] coordination. Via common edges the AuTe₆ and AgTe₆ polyhedra build up sheets parallel to (100). These sheets are combined to a network of Te₂ dumbbells (Te–Te=2.82 Å).

---

---

Mit 2 Abbildungen     

Quantitative P-T paths from zoned minerals: Theory and tectonic applications

An analytical approach to the analysis of zoning profiles in minerals is presented that simultaneously accounts for all of the possible continuous reactions that may be operative in a given assemblage. The method involves deriving a system of simultaneous linear differential equations consisting of a Gibbs-Duhem equation for each phase, a set of linearly independent stoichiometric relations among the chemical potentials of phase components in the assemblage, and a set of equations describing the total differential of the slope of the tangent plane to the Gibbs free energy surface of solid solution phases. The variables are the differentials of T, P, chemical potentials of all phase components, and independent compositional terms of solid solution phases. The required input data are entropies, volumes, the compositions of coexisting phases at a reference P and T, and an expression for the curvature of the Gibbs functions for solid solution phases. Results derived are slopes of isopleths (dP/dT, dX/dT or dX/dP) which can be used to contour P-T diagrams with mineral composition.To interpret mineral zoning, T and P can be expressed as functions of n independent composition parameters, where n is the variance of the mineral assemblage. The total differentials of P and T are differential equations that can be solved by finite difference techniques using the derivatives obtained from the analytical formulation of phase equilibria.Results calculated from Zone I and Zone IV garnets of Tracy et al. (1976) indicate that Zone I garnets grew while T increased (T+72° C) and P decreased sharply (P–3 kb). Zone IV garnets zoned in response to decreasing T (T–17° C) and P (P–1 kb). A P-T path calculated for a zoned garnet from the Greinerschiefer series, western Tauern Window, Austria, also indicates growth during decompression (–3kb) and heating (T+15° C). A P-T path calculated for the Wissahickon schist (Crawford and Mark 1982) indicates growth during cooling and compression (T–25 C, P+2.2 kb). The calculated P-T paths differ according to structural environment and can be used to relate mineral growth to tectonic processes.     

An occurrence of ardennite in quartz veins in piemontite schist,Western Otago,New Zealand

Summary Ardennite of complex composition: (Mn²⁺ _3.488Ca_0.509Ba_0.002)₌₄(Mg_0.916916 Fe³⁺ _0.165 Mn³⁺ _0.099Cu_0.033Ni_0.009Zn_0.006 Ti_0.008Al_4.764)₌₆(As⁵⁺ _0.823V⁵⁺ _0.022P_0.005B_0.069Al_0.042Si_5.039)₌₆O_21.81(OH)_6.17 occurs in crack-seal quartz veins in quartz-albite-piemontite-spessartine-phengitehematite-chlorite-rutile-tourmaline ± calcite schist of the Haast Schist Group near Arrow Junction, western Otago, New Zealand. The Mn²⁺/Mn³⁺-ratio is sensitive to calculations and to accuracy of analyses. Boron is detected in ardennite for the first time. Other properties include = 1.734(3), = 1.735(3), = 1.751(3), 2V_Z = 30(2)°;a = 8.721(1),b = 5.816(1),c = 18.545(3) Å,V = 940.7(2) ų. Associated mineral phases are spessartine, hematite, piemontite containing 0.7% SrO and 0.06% PbO, and phengite. Later-stage vein minerals comprise chlorite, albite, and manganoan calcite which were deposited under less highly oxidizing conditions. Digenite with minor intergrown covellite occurs in small amount with manganoan calcite and quartz in a cross-cutting late-stage veina chalcopyrite and native copper occur in other late-stage veins. Arsenic and other components of the ardennite and associated minerals are derived from highly oxidized ferromanganese oxide- and hydroxide-bearing siliceous pelagic sediments that formed the protolith for the piemontite schist. The veins formed at a relatively early stage after metamorphism peaked in the chlorite zone of the greenschist facies under conditions that have been estimated at about 4.5 kbar, 390 °C.

---

Vorkommen von Ardennit in Quarzgängen aus Piemontit-Schiefern, West-Otago, Neuseeland

Zusammenfassung Ardennit mit der Zusammensetzung (Mn²⁺ _3.488Ca_0.509Ba_0.002)₌₄(Mg_0.916Fe³⁺ _0.165Mn³⁺ _0.099Cu_0.033Ni_0.009Zn_0.006 Ti_0.008Al_4.764)₌₆(As⁵⁺ _0.823V⁵⁺ _0.022P_0.005B_0.069Al_0.042Si_5.039)₌₆O_21.81(OH)_6.17 tritt in Crack-seal-Quarzgängen in Quarz-Albit-Piemontit-Spessartin-Phengit-Hämatit-Chlorit-Rutil-Turmalin ± Calcit-Schiefern der Haast Schiefer-Gruppe nahe der Arrow Junction, West-Otago, Neuseeland, auf. Die Proportionen von Mn²⁺/Mn³⁺ hängen von der Kalkulation und der Genauigkeit der Analyse ab. Bor wird zum ersten Mal im Ardennit bestimmt. Andere Eigenschaften sind: = 1.734(3), = 1.735(3), = 1.751(3), 2Vz = 30(2)°; a = 8.721(1), b = 5.816(1), c = 18.545(3) Å, V = 940.7(2) Å3. Assoziierte Mineralphasen sind Spessartin, Hämatit, Piemontit, der 0.7% SrO und 0.06% PbO enthält und Phengit. Spät gebildete Gangmineralien, wie Chlorit, Albit und Mn-Calcit, sind unter geringer oxidierenden Bedingungen entstanden. Digenit mit etwas Covellin tritt in kleinen Mengen zusammen mit Mn-Calcit und Quartz in einem querschlägigen Gang auf, Chalcopyrit und gediegenes Kupfer kommen in anderen späten Gängen vor. Arsen und andere Komponenten des Ardennites and der assoziierten Minerale können von hochoxidierten, Fe-Mn-Oxid- und Hydroxyd-führenden, Sireichen, pelagischen Sedimenten hergeleitet werden, die das Ausgangsgestein für den Piemontit darstellen. Die Gänge wurden in einem relativ frühen Stadium, nach dem Metamorphosehöhepunkt, innerhalb der Chloritzone der Grünschiefer-Fazies, unter ungefähr 4.5 kbar und 390°C, gebildet.

---

---

With 4 Figures     

Röntgenuntersuchung der wasserfreien Sulfate der dreiwertigen Metalle Eisen,Chrom und Gallium

Zusammenfassung Wasserfreies Eisen(III)sulfat, Fe₂(SO₄)₃, existiert in zwei Modifikationen. Nach Einkristallaufnahmen kristallisiert die eine wahrscheinlich in Raumgruppe (a_rh=8,791±0,004 Å, =55°52±2; Z=2), die andere in Raumgruppe C _2h ⁵ –P2₁/n (a=8,296±0,002 Å, b=8,515±0,002 Å, c=11,60±0,002 Å, =90°30; Z=4). Von Cr₂(SO₄)₃ und Ga₂(SO₄)₃ konnten für die rhomboedrischen Modifikationen, die isotyp zu jener von Fe₂(SO₄)₃ sind, aus Pulveraufnahmen die Gitterkonstanten bestimmt werden.

---

Summary Anhydrous iron(III)sulfate exists in two modifications. From single-crystal work, one of the modifications crystallizes probably in space group (a_rh=8.791±0.004 Å, =55°52±2; Z=2), whereas the other in space group C _2h ⁵ –P2₁/n (a=8.296±0.002 Å, b=8.515±0.002 Å, c=11.60±0,002 Å, =90°30; Z=4). The lattice constants of the rhombohedral modifications of Cr₂(SO₄)₃ and Ga₂(SO₄)₃, which are isomorphous with rhombohedral Fe₂(SO₄)₃, have been determined from powder photographs.

---

---

Herrn Professor Dr.F. Machatschki zum 70. Geburtstag gewidmet.     

Refinement of the crystal structure of papagoite,CaCuAlSi2O6(OH)3

Summary The crystal structure of papagoite, CaCuAlSi₂O₆(OH)₃, monoclinic,a = 2.926 (3),b = 11.496 (3),c = 4.696 (1) Å, = 100.81 (2)°, V = 685.4 (3) ų, space groupC 2/m,Z = 4, has been refined to anR index of 3.4% for 913 observed reflections measured with MoK X-radiation. The single unique Cu cation is surrounded by six anions in a pseudo-octahedral arrangement showing strong Jahn-Teller distortion. Edge-sharing rutile-like chains of pseudo-octahedrally coordinated Cu and Al extend in the Y direction, and are cross-linked into an octahedral sheet by Ca₂Ø₁₀ (O = unspecified ligand, O or OH) dimers. These sheets are linked by (Si₄O₁₂) rings to form a mixed tetrahedral-octahedral framework.

---

Verfeinerung der Kristallstruktur von Papagoit, CaCuAlSi₂O₆(OH)₃

Zusammenfassung Die Kristallstruktur von Papagoit, CaCuAlSi₂O₆(OH)₃, monoklina = 12,926 (3),b = 11.496 (3),c = 4.696 (1) Å, = 100.81 (2)°,V = 685.4 (3) ų, RaumgruppeC2/m,Z = 4, wurde für 913 beobachtete, MoK-Röntgenstrahlung gemessene Reflexe aufR = 3,4% verfeinert. Das eine symmetrieunabhängige Kupfer-Kation ist pseudooktaedrisch von sechs Anionen mit einer starken Jahn-Teller-Verzerrung umgeben. Die pseudo-oktaedrisch koordinierten Cu- und Al-Atome werden über Kanten zu parallel zur y-Achse verlaufenden rutil-ähnlichen Ketten verbunden, die zusammen mit den Ca₂Ø₁₀-Gruppen (Ø = nicht spezifsierter Ligand, O bzw. OH) Oktaederschichten bilden. Diese Schichten werden durch (Si₄O₁₂)-Ringe zu einem aus Tetraedern und Oktaedern bestehenden Netzwerk verknüpft.

---

---

With 4 Figures     

Changes in stable isotope ratios of metapelites and marbles during regional metamorphism,Mount Lofty Ranges,South Australia: implications for crustal scale fluid flow

The Mount Lofty Ranges comprises interlayered marbles, metapsammites, and metapelites that underwent regional metamorphism during the Delamarian Orogeny at 470–515 Ma. Peak metamorphic conditions increased from lowermost biotite grade (350–400°C) to migmatite grade (700°C) over 50–55 km parallel to the lithological strike of the rocks. With increasing metamorphic grade, ¹⁸O values of normal metapelites decrease from 14–16 to as low as 9.0, while ¹⁸O values of calcite in normal marbles decrease from 22–24 to as low as 13.2 These isotopic changes are far greater than can be accounted for by devolatilisation, implying widespread fluid-rock interaction. Contact metamorphism appears not to have affected the terrain, suggesting that fluid flow occurred during regional metamorphism. Down-temperature fluid flow from synmetamorphic granite plutons (¹⁸O=8.4–8.6) that occur at the highest metamorphic grades is unlikely to explain the resetting of oxygen isotopes because: (a) there is a paucity of skarns at granite-metasediment contacts; (b) the marbles generally do not contain low-XCO₂ mineral assemblages; (c) there is insufficient granite to provide the required volumes of water; (d) the marbles and metapelites retain a several permil difference in ¹⁸O values, even at high metamorphic grades. The oxygen isotope resetting may be accounted for by along-strike up-temperature fluid flow during regional metamorphism with time-integrated fluid fluxes of up to 5x10⁹ moles/m² (10⁵ m³/m²). If fluid flow occurred over 10⁵–10⁶ years, estimated intrinsic permeabilities are 10^-20 to 10^-16m². Variations in ¹⁸O at individual outcrops suggest that time-integrated fluid fluxes and intrinsic permeabilities may locally have varied by at least an order of magnitude. A general increase in XCO₂ values of marble assemblages with metamorphic grade is also consistent with the up-temperature fluid-flow model. Fluids in the metapelites may have been derived from these rocks by devolatilisation at low metamorphic grades; however, fluids in the marbles were probably derived in part from the surrounding siliceous rocks. The marble-metapelite boundaries preserve steep gradients in both ¹⁸O and XCO₂ values, suggesting that across-strike fluid fluxes were much lower than those parallel to strike. Up-temperature fluid flow may also have formed orthoamphibole rocks and caused melting of the metapelites at high grades.This paper is a contribution to IGCP Project 304 Lower Crustal Processes     

Refinement of the crystal structure of beryllonite,NaBePO4

Summary The refined lattice parameters of beryllonite are:a=8.178 (3) Å,b=7.818 (2) Å,c=14.114 (6) Å, =90.00° (2); space groupP2₁/n,Z=12. Integrated Weissenberg photographs were taken by using CuK radiation and multiple film packs. The anisotropic refinement of the crystal structure by means of least-square methods gave a finalR value of 0.063 for the 1388 observed reflections. In the crystal structure PO₄ and BeO₄ tetrahedra, linked by shared oxygen atoms in a three-dimensional network, form pseudo-ditrigonal rings perpendicular to theb axis. The independent Na atoms lying in the channels formed by the rings are coordinated as an irregular nine-cornered polyhedron and as distorted octahedra.

---

Verfeinerung der Kristallstruktur des Beryllonits,NaBePO ₄

Zusammenfassung Verfeinerte Gitterkonstanten des Beryllonits lauten:a=8,178 (3) Å,b=7,818 (2) Å,c=14,114 (6) Å, =90,00 (2)°; Raumgruppe:P2₁/n,Z=12. Integrierte Weissenbergaufnahmen wurden mit CuK-Strahlung und multiplen Filmpaketen aufgenommen. Die anisotrope Verfeinerung der Kristallstruktur nach der Methode der kleinsten Quadrate ergab für 1388 beob. Reflexe einen abschließendenR-Wert von 0,063. In der Kristallstruktur bilden PO₄-und BeO₄-Tetraeder, die über gemeinsame Sauerstoffe zu einem dreidimensionalen Gerüst verknüpft sind, pseudo-ditrigonale Ringe senkrecht zurb-Achse. Die kristallographisch unabhängigen Arten von Na-Atomen, welche in den aus Ringen gebildeten Kanälen liegen, sind in der Form eines unregelmäßigen neuneckigen Polyeders bzw. in der Form verzerrter Oktaeder koordiniert.

---

---

With 2 Figures     

The crystal structures of CuSO4 · H2O and CuSeO4 · H2O,and their relationships to kieserite

Summary The crystal structures of hydrothermally grown CuSO₄ · H₂O and CuSeO₄ · H₂O were determined by single crystal X-ray methods [Space group ,a = 5.037 (1), 5.129 (1) Å,b = 5.170(1), 5.527(1)Å,c = 7.578(2), 7.469(2)Å, = 108.62(1), 103.98(1)°, = 108.39(1), 106.52(1)°, = 90.93(1), 97.19(1)°; Z = 2; R_w = 0.026, 0.030 for 2065, 2235 reflections with sin / 0.90 Å^–1]. The Cu atoms are [4 + 2]-coordinated to O atoms. These elongated octahedra are corner connected via the H₂O molecule to form chains. The formal units ¹ [Cu₂O₈(H₂O)2]^12- are interconnected by [XO₄]^2- groups (X=S,Se) and hydrogen bonds (bond lengths 2.72–2.83 Å). The crystal structures show pseudomonoclinic symmetry and are strongly related to the structure type of kieserite.[/p]

---

Die Kristallstrukturen von CuSO₄ · H₂O und CuSeO₄ · H₂O und ihre Beziehungen zum Kieserit

Zusammenfassung Die Kristallstrukturen von hydrothermal gezüchtetem CUSO₄ · H₂O und CuSeO₄. H₂O wurden an Einkristallen mittels Röntgenbeugung bestimmt [Raumgruppe ;a = 5.037(1), 5.129(1)Å,b = 5.170(1), 5.527(1)Å,c = 7.578(2), 7.469 (2) Å, = 108.62(1), 103.98(1)°, = 108.39(1), 106.52(1)°, = 90.93(1), 97.19(1)°; Z = 2; R_W = 0.026, 0.030 für 2065, 2235 Reflexe mit sin / 0.90)Å^–1]. Die Cu-Atome werden durch O-Atome [4+2]-koordiniert. Diese gestreckten /lOktaeder sind miteinander über Ecken durch die H₂O-Moleküle zu Ketten verknüpft. Die formalen Einheiten ¹ [CU₂O₈(H₂O)₂]^12– werden durch [XO₄]^2–-Gruppen (X = S, Se) und Wasserstoffbrücken (Bindungslängen 2.72–2.83Å) miteinander verbunden. Die Kristallstrukturen zeigen pseudomonokline Symmetrie und sind sehr nahe mit dem Strukturtyp des Kieserits verwandt.

---

---

With 1 Figure     

Rooseveltit von San Francisco de los Andes und Cerro Negro de la Aguadita,San Juan,Argentinien

Zusammenfassung Rooseveltit findet sich in der Oxidationszone der Lagerstätten San Francisco de los Andes und Cerro Negro de la Aguadita, in der Provinz San Juan, Argentinien, auf 30°22 S und 69°33 W. Er bildet sehr feinkörnige, weiß-graue, nach Bismuthinit pseudomorphe Aggregate. Die Brechungsindizes liegen zwischenn=2,10 und 2,30. Die Vickershärte beträgt 513 (4–5 der Mohs'schen Härteskala). Mittels Elektronenmikrosonde wurde folgende chemische Zusammensetzung bestimmt: As=21,5±1%, Bi=60,9±2%. Rooseveltit ist monoklin mita ₀=6,878(1)Å, b₀=7,163(1) Å, c₀=6,735(1) Å, =104° 46±1, Z=4, _calc.=6,94 g·cm^–3, RaumgruppeP 2₁/n.Rooseveltit wurde nach drei verschiedenen Methoden synthetisiert. Die Pulverdiagramme der synthetischen Produkte stimmen mit dem des Minerals überein. Die Brechungsindizes wurden mitn =2,13(2) bzw. n=2,25(2) und die Dichte mit _obs.=7,01 g·cm^–3 bestimmt. Zellparameter: a₀-6,882(1) Å, b₀=7,164(1) Å, c₀=6,734(1) Å, =104° 50,5±0,7, _calc.=6,94 g·cm^–3. Das synthetische Material schmilzt um 950°C. Selbst nach mehrstündigem Erhitzen auf 920°C läßt sich keine Veränderung im Pulverdiagramm des Minerals festellen.Es wird versucht, die natürliche Bildung des Rooseveltits zu erklären.

---

Rooseveltite from San Francisco de los Andes and Cerro Negro de la Aguadita, San Juan, Argentina

Summary Rooseveltite occurs in the weathering zone of the San Francisco de los Andes and Cerro Negro de la Aguadita mines, located in the San Juan Province, Argentina, at 30° 22S and 69° 33W. It appears in grey, finegrained aggregates pseudomorph after bismuthinite. Refraction index ranges fromn=2.10 to 2.30. The Vickers microhardness is 513 (4–5 of Mohs' scale). Chemical composition from electron micro probe measurements is As 21.5±1% and Bi 60.9±2%. Rooseveltite is monoclinic, with a₀=6.878(1) Å, b₀=7.163(1) Å, c₀=6.735(1) Å, =104° 46±1, Z=4, _calc.=6,94 g·cm^–3, space groupP 2₁/n.The synthetic compound was prepared by three different methods. The powder pattern are the same as that of the mineral. Refraction index n=2.13(2) and n=2.25(2). The measured specific gravity is _pobs.=7,01 g·cm^–3. Cell parameters: a₀=6.882(1) Å, b₀=7.164(1) Å,c ₀=6.734(1) Å, =104° 50.5±0.7, _calc.=6,94 g·cm^–3. The synthetic material melts at about 950°C. After heating to 920°C no variations were observed in the powder diagram of the mineral.It is tried to explain the formation of rooseveltite in natural environment.

---

---

Mit 2 Abbildungen     

A re-appraisal of the chemical formula of nealite,Pb4Fe(AsO3)2Cl4 . 2H2O,on the basis of a crystal structure determination

Summary A crystal structure determination of the mineral nealite, Pb₄Fe(AsO₃)₂Cl₄ . 2H₂O, (a = 6.548(4), b = 10.243(8), c = 5.587(3) [Å]; = 96.2(1), = 89.6(1), = 97.7(1) [°]; Z = 1; space group ) was performed using single crystal X-ray data and a direct method strategy; the structural parameters were fitted by least squares techniques. The structure is characterized by isolated FeO₂Cl₂(H₂O)₂ octahedra (Fe-O: 2.08 Å, 2x, and 2.12 Å, 2x, Fe-Cl: 2.60 Å, 2x) and AsO₃ pyramids (As-O from 1.79 to 1.89 Å) which are connected by PbO₄Cl₄ and PbO₅Cl₄ polyhedra to a framework (with Pb-O distances from 2.22 to 3.34 Å, Pb-Cl distances from 3.10 to 3.54 Å). Oscillation photographs, exposed for 20 h, show very faint streaks indicating a doubling of c, probably caused by a partial ordering of a split lead atom position. Nealite is the first mineral found to contain a divalent iron atom coordinated to oxygen and chlorine atoms simultaneously.

---

Änderung der chemischen Formel des Nealits, Pb₄Fe(AsO₃)₂Cl₄ . 2H₂O, basierend auf der Kristallstrukturbestimmung

Zusammenfassung Die Kristallstrukturbestimmung des Minerals Nealit, Pb₄Fe(AsO₃)₂Cl₄ . 2H₂O, a = 6.548(4), b = 10.243(8), c = 5.587(3) [Å]; = 96.2(1), = 89.6(1), = 97.7(1) [°]; Z = 1; Raumgruppe ) wurde anhand von röntgenographischen Einkristalldaten mit direkten Methoden durchgeführt und die Strukturparameter nach der Methode der kleinsten Quadrate verfeinert. Die Kristallstruktur ist charakterisiert durch isolierte FeO₂Cl₂(H₂O)₂-Oktaeder (Fe-O: 2.08 Å, 2x, und 2.12 Å, 2x, Fe-Cl: 2.60 Å, 2x) und AsO₃-Pyramiden (As-O von 1.79 Å bis 1.89 Å), welche durch PbO₄Cl₄ und PbO₅Cl₄-Polyeder zu einem Gerüst verknüpft sind (Pb-O von 2.22 bis 3.34 Å und Pb-Cl von 3.10 bis 3.54 Å). Schwenkaufnahmen, etwa 20 h belichtet, zeigen sehr feine Schwärzungsstreifen, die auf eine Verdopplung von c hinweisen, möglicherweise durch eine teilweise Ordnung einer aufgespaltenen Position eines Bleiatoms hervorgerufen. Nealit ist das erste Mineral, in dem ein zweiwertiges Eisenatom gleichzeitig an Sauerstoff- und Chloratome gebunden ist.

---

---

Dedicated to Prof. Dr. Josef Zemann (Vienna) on the occasion of his 70^th birthday

---

With 1 Figure     

Mg tracer diffusion in synthetic forsterite and San Carlos olivine as a function of P,T and fO2

We present new experimental data on Mg tracer diffusion in oriented single crystals of forsterite (Fo₁₀₀) and San Carlos olivine (Fo₉₂) between 1000–1300° C. The activation energies of diffusion are found to be 400 (±60) kJ/mol (96 kcal/mol) and 275 (±25) kJ/mol (65 kcal/ mol) in forsterite and San Carlos olivine, respectively, along [001] at a fO₂ of 10^–12 bars. There is no change in activation energy of Mg tracer diffusion within this temperature range. Mg tracer diffusion in a nominally pure forsterite is found to be anisotropic (D_c > D_a > D _b) and a function of fO₂. This fO₂ dependence is different from that in olivine containing Fe as a major element, which suggests that the diffusion mechanism of Mg in forsterite is different from that in Fe-bearing olivine at least over some range of fO₂. The diffusion mechanism in nominally pure forsterites may involve impurities present below the limits of detection or alternately, Si or Fe³⁺ interstitial defects, Fe being present as impurity (ppm level) in forsterite. Pressure dependence of Mg tracer diffusivity in forsterite measured to 10 GPa in a multianvil apparatus yields an activation volume of approximately 1–3.5 cm³/ mol. It is found that presence of small amounts of hydrogen bearing species in the atmosphere during diffusion anneal (f_H2 0.2 bars, f_H20 0.24 bars) do not affect Mg tracer diffusion in forsterite within the resolution of our measurement at a total pressure of 1 bar. The observed diffusion process is shown to be extrinsic; hence extrapolation of the diffusion data to lower temperatures should not be plagued by uncertainties related to change of diffusion mechanism from intrinsic to extrinsic.     

Kornerupine in Mg-Al-rich gneisses from Namaqualand,South Africa: mineralogy and evidence for late-metamorphic fluid activity

Three kornerupine occurrences are reported in distinctive SiO₂-poor, MgO- and Al₂O₃-rich paragneisses from the Namaqualand Metamorphic Complex in South Africa. Kornerupine coexists stably with phlogopite, cordierite, orthopyroxene, gedrite, sapphirine, sillimanite and plagioclase and, in sapphirine-free rocks, with spinel and corundum. Tourmaline of a texturally older generation than kornerupine is commonly present in the same samples.Ten analysed kornerupines show a variation in total Fe as FeO from 1.8 to 10.9 weight per cent. B₂O₃ contents are estimated from x-ray data and a few spectrochemical analyses to range from 0.9 to 3.5 weight per cent. There is a strong inverse correlation between B³⁺ and Al³⁺. Total iron content has a strong and systematic effect on refractive index, colour and dispersion. Fe and Mg are systematically partitioned with the other minerals, and Mg/(Mg+Fe) ratios increase as follows: spinel 相似文献   

Natural boehmite single crystals from Ceylon

Single crystals of boehmite, up to 0.1 mm in size, were found in open cavities inside a corundum crystal from the Ratnapura area gem gravels in Ceylon. The unit cell parameters are (X-ray powder pattern): a ₀=3.695 Å b ₀=12.212 Å, c ₀=2.867 Å. The crystallographic orientation is based on X-ray single-crystal precession photographs. The crystals show the faces (it010), (001), (101), and (221). Systematic extinctions agree with the space group Amam. Optical orientation: a, b, c. Refractive indices are given. The mineral is optically positive with a large optic axial angle.     

The genesis of emeralds and their host rocks from Swat,northwestern Pakistan: a stable-isotope investigation

Emerald deposits in Swat, northwestern Pakistan, occurring in talc-magnesite and quartz-magnesite assemblages, have been investigated through stable isotope studies. Isotopic analyses were performed on a total of seven emeralds, associated quartz (seven samples), fuchsite (three samples) and tourmaline (two samples) from the Mingora emerald mines. The oxygen isotopic composition ( ¹⁸O SMOW) of emeralds shows a strong enrichment in¹⁸O and is remarkably uniform at + 15.6 ± 0.4 (1,n = 7). Each of the two components of water in emerald (channel and inclusion) has a different range of hydrogen isotopic composition: the channel waters being distinctly isotopically heavier (D = –51 to –32 SMOW) than the other inclusion waters (D = –96 to –70 SMOW). Similarly the oxygen isotopic compositions of tourmaline and fuchsite are relatively constant ( ¹⁸O = + 13 to + 14 SMOW) and show enrichment in¹⁸O. The ¹⁸O values of quartz, ranging from + 15.1 to + 19.1 SMOW, are also high (+ 16.9 ± 1.4 1, n = 7). The meanD of channel waters measured from emerald (–42 ± 6.6 SMOW) and that of fluid calculated from hydrous mineralsD_calculated (–47 ± 7.1 SMOW) are consistent with both metamorphic and magmatic origin. However, the close similarity between the measuredD values of the hydroxyl hydrogen in fuchsite (–74 to –6 SMOW) and tourmaline (–84 and –69 SMOW) with pegmatitic muscovite and tourmaline suggests that the mineralization was probably caused by modified (¹⁸O-enriched) hydrothermal solutions derived from an S-type granitic magma. The variation in the carbon and oxygen isotopic composition of magnesite, locally associated with emerald mineralization, is also very restricted ( ¹³ –3.2 ± 0.7%, PDB; ¹⁸O + 17.9 ± 1.27 SMOW). On the basis of the isotopic composition of fluid ( ¹³C –1.8 ± 0.7 PDB; ¹⁸O + 13.6 ± 1.2 SMOW calculated for the 250-550 °C temperature), it is proposed that the Swat magnesites formed due to the carbonation of previously serpentinized ultramafic rocks by a CO₂-bearing fluid of metamorphic origin.     

Reaction progress during mylonitization of basaltic dikes along the Särv thrust,Swedish Caledonides

The mylonite zone at the base of the Särv thrust sheet, Swedish Caledonides, contains diabase dikes which record intense deformation and syntectonic greenschist facies metamorphism. An angular shear strain of 100 is calculated for a single dike which can be followed for 50 m in the mylonite zone and abundant centimeter thick greenschist layers imply shear strains in excess of 1000. This extraordinary amount of deformation is comparable to the largest strains attained during experimental superplastic deformation of metals and alloys and, by analogy, suggests that dike deformation was macroscopically superplastic. The progress of five syntectonic reactions was measured as a function of increasing strain for the continuously exposed dike in order to assess the contribution of reactionenhanced ductility and fluid-rock interactions to strain localization along the thrust. Reaction progress calculations suggest that the breakdown of amphibole to form weaker phyllosilicates (which are added to the incompetent matrix fraction) is the important strain softening mechanism below 100. The ultimate tectonite is a stable biotite-epidote schist comprised of a uniformly fine grain size (< 200 m), constant grain shapes and strain free grains. Below 40, metamorphism was isochemical and shear strain was independent of H₂O in the reactions. Petrologic fluid:rock ratios are low and suggest that deformation could have occurred under relatively dry conditions.Deformation micromechanisms were probably dominated by diffusive mass transfer processes throughout the life of the shear zone. The absence of cataclasis and the fine grain size of the protolith basalt suggest that fluids were introduced via grain boundary diffusion. Incongruent pressure solution at low strains and K-metasomatism above 40 also support diffusional flow. Diffusion-accomodated grain boundary sliding is thought to be the dominant micromechanism once the stable biotite-epidote tectonite forms.     

Crystal structure of KMn3+ [SeO4]2 — a triclinic distorted member of the Yavapaiite family

Summary The crystal structure of synthetic KMn[SeO₄]₂ was determined by single crystal X-ray diffraction methods in space group , a = 4.827(2) Å, b = 4.988(2) Å, c = 7.981(3) Å, = 83.18(1)°, = 85.32(2)°, = 67.92(1)°, V = 176.66 ų, Z = 1; 1564 unique data, measured up to 2 = 70° (MoK-radiation); R, R(I)_w = 0.034, 0.074.KMn[SeO₄]₂ is closely related to monoclinic yavapaiite, KFe[SO₄]₂, and isotypic compounds. Jahn-Teller distorted MnO₆ octahedra are alternately linked with KO₁₀ polyhedra along [001]. The mean values of the Mn-O and Se-O distances are 2.007 Å and 1.637 Å, respectively.

---

Die Kristallstruktur vonKMn ³⁺[SeO₄]-einem triklin verzerrten Vertreter der Yavapaiite-Familie

Zusammenfassung Die Kristallstruktur von synthetisch dargestelltem KMn[SeO₄]₂ wurde mittels Einkristallröntgenmethoden in der Raumgruppe bestimmt: a = 4.827(2) Å, b = 4.988(2) Å, c = 7.981(3) Å, = 83.18(1)°, = 85.32(2)°, = 67.92(1)°, V = 176.66 ų, Z = 1; 1564 unabhängige Daten bis 2 = 70° (MoK-Strahlung); R, R(I)_w = 0.034, 0.074.KMn[SeO₄]₂ ist eng mit dem monoklinen Mineral Yavapaiit, KFe[SO₄]₂ und einer Reihe damit isotyper Verbindungen verwandt. Jahn-Teller verzerrte MnO₆ Oktaeder sind alternierend mit KO₁₀ Polyedern parallel [001] verbunden. Die Mittelwerte der Mn-O und Se-O Abstände sind 2.007 Å bzw. 1.637 Å.

---

---

With 1 Figure