天然晶质富Ti和Fe2+硅钛铈矿的晶体结构

对产于内蒙白云鄂博晶态富Ti和Fe2 的硅钛铈矿Ce4Fe2 (Ti,Fe2 )2Ti2Si4O22进行了晶体结构的精测,求得晶胞参数:a=1.34656(15)nm,b=0.57356(6)nm,c=1.10977(12)nm,β=100.636°(2),晶胞体积V=0.84239(16)nm3。单位晶胞中的分子数Z=2。晶体结构测定中分别用P21/a和C2/m空间群来进     

新矿物丁道衡矿-（Ce）：珀硅钛铈矿的同质多象体和硅钛铈矿亚族C（1）位上的钛类似矿物

丁道衡矿-(Ce):(Ce,La)4Fe2 (Ti,Fe2 ,Mg,Fe3 )2Ti2Si4O22,理想的结构化学式Ce2Ce2Fe2 Ti2Ti2Si4O22单斜晶系,α=1.34656(15)nm,b=0.57356(6)nm,c=1.10977(12)nm,β=100.636(2)°,V=0.84239(46)nm3,空间群P21/a(假C2/m),Z=2.作为硅钛铈矿(chevkinite)族矿物的新成员,它产于举世闻名的白云鄂博铁.稀土.铌矿床镁夕卡岩中,多数单晶体长0.2～1.0 cm,最大者长大于1.5 cm.共生矿物有透辉石、透闪石、钠透闪石、褐帘石-(Ce)、磁铁矿、尖晶石、烧绿石、氟金云母、氟磷灰石、石英和萤石等.矿物具有褐色条痕和半金属一金属光泽的黑色,其褐黑色碎片半透明.性脆、具有贝壳状断口、无解理和裂开.显微硬度(VHN25g)为606.0～717.4 kg/mm/12(相当于摩氏硬度约5.9).矿物实测密度4.83(7)g/cm3,计算密度值4.88(0)g/cm3.丁道衡矿-(ce)的反射色为带灰色的浅黄色,多色性为不同色调的灰色.平均反射率(λ=589nm)为11.4%～12.5%.矿物为二轴晶负光性.作过结构精测的丁道衡矿-(Ce)晶体的电子探针测值:SiO2:19.29,TiO2:18.26,A12O3:0.04,FeO:8.49,Fe2O3,:1.67,ThO2:0.16,MgO:1.32,CaO:2.17,Nb2O5:0.47,Ta2O5:0.00,La2O3:19.53,Ce2O3:28.08,Y2O3:0.00,Na1O:0.01,总量99.46%;其中Fe3 /Fe2 的比值依穆斯堡尔谱换算.根据结构精测每个单位分子式中O=22和C(1)位上Ti优先占位,计算的矿物晶体化学式为(Ce2.13,La1.49Ca0.48Th0 01)Σ4.11Fe2 (Tin0.88Fe2 0.47Mg0.41 Fe0.0)Σ2.03(Ti1.96Nb0 04)Σ2.00(Si2O7)2O3.分别用P21/a和C2/m对丁道衡矿-(Ce)的晶体结构作了精测.结果表明,丁道衡矿-(Ce)的真空间群是P20/a.换言之,它才是真正珀硅钛铈矿[perrierite-(Ce)]的同质多象体.显而易见,硅钛铈矿族矿物既可以有P21/a空间群,又可以有C2/m空间群.     

C2/m丁道衡矿-(Ce)的发现与研究

丁道衡矿-(Ce)是在白云鄂博REE-Nb-Fe矿发现的一种新的稀土元素矿物,被视为是真正的珀硅铈钛矿(Perrierite)的同质多象体和硅钛铈矿(Chevkinite)亚族C(1)位上的钛类似物。同时,它还是自然界发现的首例硅钛铈矿亚族具P21/a空间群的天然产物。之后,在攀枝花V-Ti-Fe矿红格矿区找到一种几可全方位同白云鄂博产原型丁道衡矿-(Ce)对比,但空间群为C2/m的丁道衡矿-(Ce)变体,并作了全面、系统的矿物学研究。自此,参照先例,攀枝花产具C2/m空间群的丁道衡矿-(Ce)宜称C2/m丁道衡矿-(Ce);而白云鄂博原型丁道衡矿-(Ce)宜称P21/a丁道衡矿-(Ce)。C2/m丁道衡矿-(Ce)的发现与研究揭示,已有的硅钛铈族矿物何以具有C2/m变体和P21/a变体的成因解释,尚不能圆满诠释2种变体的形成。     

桐柏矿的晶体结构测定

桐柏矿(Cr3C2)是我国1983年发现的新矿物,因当时实验条件所限仅进行了晶体学参数测定而未进行晶体结构测定。最近在西藏罗布莎蛇绿岩块铬铁矿矿床中又一次发现该矿物,并获得了适宜进行X射线单晶衍射分析的单晶颗粒。采用SMARTAPEX单晶衍射仪电子耦合探测器技术,对该矿物进行了晶体结构的精确测定。测得该矿物属斜方晶系,空间群为Pnam,晶胞参数为a=0.5525(2)nm,b=1.1468(4)nm,c=0.2827(1)nm,晶胞体积V=0.1791(1)nm3,得到了精确的Cr和C原子坐标及其它晶体学参数,单位晶胞内分子个数Z=4{Cr3C2},计算密度D=6.677g/cm3,结构测定精度R(I>2σ(I))=0.0361。测定表明,该矿物属过渡金属碳化物结构,金属原子Cr与C原子呈非等大球的密堆积,C原子与最近邻的6个Cr原子配位,呈三方柱配位多面体,三方柱之间以共棱和共面方式连接。两种[CCr6]三方柱中,Cr—C平均键长分别为0.2047nm及0.2083nm。本文对该矿物与其它类似的过渡金属元素碳化物的晶体结构进行了对比研究。     

氟铁云母的晶体结构分析

氟铁云母是三八面体云母类矿物新种,属铁云母的富氟类似物.利用电子探针、湿法和原子吸收分析等手段并结合穆斯堡尔谱分析的结果,按O+OH+F+Cl=12及四面体阳离子数之和为4计算的氟铁云母经验化学式为:(K0.92Na0.03Rb0.02Ba0.01)0.98(Fe1.822++Fe0.493++Al0.19Mg0.18Li0.18Ti0.08Mn0.05Zn0.02)2.99(Al1.17Si2.83)4.00O10(F1.03OH0.50O0.47)2.00.其理想化学式为:KFe32+AlSi3O10F2.使用粉晶XRD衍射仪,采用毛细管装样和超能探测器相结合收集衍射数据/图谱的微区衍射新方法收集氟铁云母的粉末衍射数据,通过构建晶体结构模型和Rietveld法晶体结构精修并收敛到Rp=2.51%,Rwp=3.19%,Rexp=2.85,X2=1.253完成晶体结构解析.矿物属于单斜晶系1M型,空间群C2/m;晶胞参数:a=0.537 05(4)nm,b=0.929 95(6)nm,c=1.017 35(6)nm;β=100.465(5)°,V=0.499 64(5)nm3;Z=2.     

新矿物——罗布莎矿的晶体结构精修

利用微量衍射方法得到的粉晶衍射数据和Rietveld全谱拟合方法精修了合金新矿物罗布莎矿(β-FeSi2)的晶体结构,新矿物计算理论分子式为Fe0.83Si2.00,属斜方晶系,空间群为Cmca,a=0.98362 nm,b=0.78301 nm,c=0.78655 nm,z=16。结构精修发现Fe有明显的占位不足,并且这种不足只表现在Fe2位置上,结构中Fe2有明显的空位缺席构造特征。     

黄河矿晶体结构的重新测定及空间群对称的讨论

黄河矿 BaCe(CO₃)₂F(a=0.5072(1)nm,c=3.846(1)nm;V=856.8×10^-3nm³;Z=6)晶体结构的重新测定,采用中心对称空间群 R3m-D_3d⁵,基于337个可观察的单晶 X 射线数据(I>2σ₁)和30个可变参数,R=0.031。原子坐标和均方根振幅(据各向异性位移参数计算,O.013-0.025nm)表明,没有必要降低对称性,即没有必要采用相应的非中心对称空间群或其它次群。黄河矿的结构中,原子形成似层状排列,且垂直于 c 轴;碳酸根通过 Ba 与 Ce 的联结形成三维结构。C(1)O₃,和 C(2)O₃,中的 C 原子偏离三个氧组成的平面,其偏离的距离分别为0.0066(15)nm 和 0.0029(15)nm。     

具一维无公度调制的安康矿的晶体结构测定

安康矿是在陕西省安康石梯重晶石矿床中发现的一种新矿物。分子式近于Ba_(1·2)(Ti_(5·3)V_(2.8))_(8.1)O_(16),沿C轴具一维无公度调制结构,调制波向量为q=1/2.30C。安康矿的平均结构与锰钡矿是等结构。空间群为14/m,a=10.139(4);b=2.961(2),Z=1。平均结构的强度数据收集是在cAD-4衍射仪上进行的。R=0.039(535个独立的衍射点)。安康矿的超晶胞是将其亚晶胞加大14倍而获得的,空间群P4/m,a=10.126(4),c=41.41(2),Z=14。用RIGAKU的RASA-ⅡS型衍射仪收集了8696个独立的衍射点,其中包括主衍射点及卫星衍射点。对于2353个可观察点经结构修正后R因子为0.2157。在四方柱孔道中测得了Ba原子的占位及位移。测定表明安康矿属占位调制及位移调制的复合型无公度调制,而且沿c轴方向为方波调制。     

蒙山矿的晶体结构

本文对产于我国山东的新矿物蒙山矿(Mathiasite)进行了晶体结构精测。蒙山矿的晶体化学式为:(K、Ca、Sr)(Ti、cr、Fe、Mg、Zr)_(21)O_(38),三方晶系,空间群R,晶胞参数:a_o=10.3722,c_o=20.7161(六方定向),a_R=9.1403,a=69.187°(菱面体定向)。应用RASA-5RP自动转靶四圆单晶衍射仪,对蒙山矿收集了独立的1554个衍射强度。经结构解析和修正,求得了晶体中各原子的坐标、温度因子、占位度。并计算了原子的间距和键角。结构修正的偏离因子: R=0.047。蒙山矿产于金伯利岩中,形成于高温高压下。通过结构测定,确定了该矿物中Ti、Cr、Mg、K等元素的配位形式,特别是查明了Zr在这种以Ti为主的复杂氧化物中有独立的结晶学位置,并有缺席现象。以上研究成果丰富了金伯利岩中金属副矿物的矿物学和晶体化学内容。     

萨碳硼镁钙石晶体结构的精确测定

本文对萨碳硼镁钙石(sakhaite)Ca_(48)Mg_(16)(BO_3)_(28)(CO_3)_(16)(Cl,F)_6(OH)_6·nH_2O的晶体结构进行了重新测定,求得晶胞参数:a=b=c=1.46151(9)nm。晶胞体积:V=3.1218(3)nm~3。单位晶胞中分子数Z=1,空间群为Fd3。结构测定的精度偏离因子R=0.0504。根据矿物化学成分及晶体结构特征,与前人报道的萨碳硼镁钙石及其人工合成矿物晶体结构特征进行了对比,指出本次测定的矿物与前人报道的天然萨碳硼镁钙石或人工合成矿物在矿物成分与结构上的差异,据此,讨论了我国产出的“萨碳硼镁钙石”有待重新命名的必要性。     

The terrestrial fauna of the Late Triassic Pant-y-ffynnon Quarry fissures,South Wales,UK and a new species of Clevosaurus (Lepidosauria: Rhynchocephalia)

Pant-y-ffynnon Quarry in South Wales yielded a rich cache of fossils in the early 1950s, including articulated specimens of new species (the small sauropodomorph dinosaur Pantydraco caducus and the crocodylomorph Terrestrisuchus gracilis), but no substantial study of the wider fauna of the Pant-y-ffynnon fissure systems has been published. Here, our overview of existing specimens, a few described but mostly undescribed, as well as freshly processed material, provides a comprehensive picture of the Pant-y-ffynnon palaeo-island of the Late Triassic. This was an island with a relatively impoverished fauna dominated by small clevosaurs (rhynchocephalians), including a new species, Clevosaurus cambrica, described here from a partially articulated specimen and isolated bones. The new species has a dental morphology that is intermediate between the Late Triassic Clevosaurus hudsoni, from Cromhall Quarry to the east, and the younger C. convallis from Pant Quarry to the west, suggesting adaptive radiation of clevosaurs in the palaeo-archipelago. The larger reptiles on the palaeo-island do not exceed 1.5?m in length, including a small carnivorous crocodylomorph, Terrestrisuchus, and a possible example of insular dwarfism in the basal dinosaur Pantydraco.     

Définition d'une limite multicritère ; stratigraphie du passage Campanien–Maastrichtien du site géologique de Tercis (Landes,SW France)Definition of a multi-criteria boundary; stratigraphy of the Campanian–Maastrichtian interval of the geological site at Tercis (Landes,SW France)

Lithostratigraphy, physicochemical stratigraphy, biostratigraphy, and geochronology of the 77–70 Ma old series bracketing the Campanian–Maastrichtian boundary have been investigated by 70 experts. For the first time, direct relationships between macro- and microfossils have been established, as well as direct and indirect relationships between chemo-physical and biostratigraphical tools. A combination of criteria for selecting the boundary level, duration estimates, uncertainties on durations and on the location of biohorizons have been considered; new chronostratigraphic units are proposed. The geological site at Tercis is accepted by the Commission on Stratigraphy as the international reference for the stratigraphy of the studied interval. To cite this article: G.S. Odin, C. R. Geoscience 334 (2002) 409–414.     

The effect of water on accessory phase solubility in subaluminous and peralkaline granitic melts

The solubilities of columbite, tantalite, wolframite, rutile, zircon and hafnon were determined as a function of the water contents in peralkaline and subaluminous granite melts. All experiments were conducted at 1035 °C and 2 kbar and the water contents of the melts ranged from nominally dry to approximately 6 wt.% H₂O. Accessory phase solubilities are not affected by the water content of the peralkaline melt. By contrast, solubilities are affected by the water content of the subaluminous melt, where the solubilities of all the accessory phases examined increase with the water content of the melt, up to 2 wt.% H₂O. At higher water contents, solubilities are nearly constant. It can be concluded that water is not an important control of accessory phase solubility, although the water content will affect diffusivities of components in the melt, thus whether or not accessory phases will be present as restite material. The solubility behaviour in the subaluminous and peralkaline melts supports previous spectroscopic studies, which have observed differences in the coordination of high field strength elements in dry vs. wet subaluminous granitic glasses, but not for peralkaline granitic glasses. Lastly, the fact that wolframite solubility increases with increasing water content in the subaluminous melt suggests that tungsten dissolved as a hexavalent species.     

Quaternary stresses revealed by calcite twinning inversion: insights from observations in the Savonnières underground quarry (eastern France)

Calcite samples were extracted both from the rock matrix and the superficial coating of a karstified fault plane of an underground quarry, located in the eastern border of the Paris basin. The karstification is dated as Quaternary. Analysis of mechanical calcite twinning reveals that only the calcite matrix has also undergone a compression trending WNW that can be attributed to the Mio-Pliocene alpine collision. Both coating and matrix have undergone a strike-slip regime with σ₁ roughly trending north–south, that could correspond to the regional present-day state of stress, a strike-slip compression rather trending NNW, modified by local phenomena. To cite this article: M. Rocher et al., C. R. Geoscience 335 (2003).     

NONMETALS DEPOSITS

正20141520 Bo Ying(Key Laboratory of Metallogeny and Mineral Assessment,MLR,Beijing 100037,China);Liu Chenglin Saline Spring Hydrochemical Characteristics and Indicators for Potassium Exploration in Southwestern and Northern Tarim Basin,Xinjiang(Acta Geoscientica Sinica,ISSN1006-3021,CN11-3474/P,34(5),2013,p.594-602,5 illus.,3 tables,28 refs.)     

MATHEMATICAL GEOLOGY

正20141243Chen Ge(Hangzhou Research Institute of Petroleum Geology,PetroChina,Hangzhou 310023,China);Si Chunsong Study on Sedimentary Numerical Simulation Method of Fan Delta Sand Body(Journal of Geology,     

PROSPECTING EXPLORATION

正20142599Chen Sanming(Guangxi Key Laboratory of Concealed Deposits Exploration,Guilin University of Technology,Guilin541004,China);He Yuzhou Block Model and Reserves Estimation of Panzhihua Iron Deposit Based on 3D Geological Modeling(Journal of Guilin University of Technology,ISSN1674-9057,CN45-1375/N,33(4),2013,p.610-615,9illus.,1table,15refs.)     

STRUCTURAL GEOLOGY

正20140594 Bai Daoyuan(Hunan Institute of Geology Survey,Changsha 410016,China);Zhong Xiang Faults in the Jingzhou Basin and Their Tectonic Settings(Geotectonica et Metallogenia,ISSN1001-1552,CN44-1595/P,37(2),2013,p.173-183,6illus.,59refs.)Key words:basin evolution,tectonic setting,South China In the Upper Paleozoic and Jurassic se-     

STRUCTURAL GEOLOGY

正20141912Cao Hui(State Key Laboratory for Continental Tectonics and Dynamics,Institute of Geology,Chinese Academy of Geological Sciences,Beijing 100037,China)Gravitational Collapse and Folding during Orogenesis:A Comparative Study of FIA Trends and Fold Axial Plane Traces(Geology in China,ISSN1000-3657,CN11-1167/P,40(6),2013,p.1818-1828,9illus.,35refs.,with