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Critical Assessment of the Mineralogical Collections at Uppsala University using Raman Spectroscopy / Kritisk studie av de mineralogiska samlingarna vid Uppsala universitet med hjälp av RamanspektroskopiZhuk, Yuliya January 2017 (has links)
The technique of Raman spectroscopy was applied in order to identify and characterize the number of minerals in the mineralogical collection at the Department of Earth Sciences. The collection was broadened with five rare carbonates borrowed from the collection of the Swedish Museum of Natural History in Stockholm. In total, 66 specimens were examined.The characteristics of interest included possible presence and nature of defects and impurities, degree of crystallinity, residual stresses, possible treatment by natural heat sources (e.g. radionuclides) or chemicals (e.g. polishing agents), and fluorescence.Raman spectroscopy was chosen as examination method because of its distinctive advantage over traditional techniques – a non-destructive probing of pristine materials and minimum or no preparation. Besides, Raman spectroscopy performs very well in collecting the needed characteristics, in terms of its sensitivity, as well ability to probe miniature grains in a matrix with a high spatial resolution.A portable system was used to identify the presence of impurities and the fingerprint of the host rock in the majority of the examined carbonates. The rare carbonate burbankite showed distinct fluorescence bands, which likely can be explained by its complicated chemical composition.The Raman system was used for gemmological purposes and helped to identify the purity of the gems. Diamond and two rubies showed to be free from impurities, but red corundum showed a broad peak, which may represent traces of natural heat treatment, which in turn could be caused by regional metamorphism or even by a radiation source. Furthermore, the correlation between the signal intensity of the fluorites’ bands and the chemical composition of the minerals were studied. The experiment showed that blue fluorite fully misses the peak T2g while purple and grey fluorites showed a well-developed and easily recognizable peak at this location. Thus, it was discovered that the presence and intensity of this peak is directly dependent on the fluorite’s colour, i.e. on the host species, which are incorporated in the crystal structure, such as metals, rare earth elements (REE) or even organic substances. Moreover, residual tensile stress was identified in colourless quartz. The tensile stress was estimated to be in the interval between 0.23 and 1.0 GPa.The Raman system was used to identify different end-members of the garnet family. Raman spectroscopy showed to have high analytical power and helped to estimate the ratio between the end-members in eight garnet samples. In one case, fluorescence was linked to the presence of REEs in the structure of almandine. One sample of calcite showed to be incorrectly placed in the collection. This work will now form a solid foundation for the mineral characteristics handbook. / Ramanspektroskopitekniken applicerades för att identifiera och karakterisera antalet mineraler i den mineralogiska samlingen vid Institutionen för geovetenskaper. Samlingen breddades med fem sällsynta karbonater som lånades från Naturhistoriska riksmuseets samling i Stockholm. Sammanlagt analyserades 66 prover. Egenskaperna av intresse inkluderade eventuell förekomst av och karaktären hos defekter och föroreningar, graden av kristallinitet, restspänningar, eventuella spår av naturlig värmebehandling (till exempel radionuklider) eller kemisk behandling (till exempel polermedel), och fluorescens. Ramanspektroskopi valdes som undersökningsmetod på grund av dess tydliga fördel över traditionella metoder – en icke-förstörande undersökning av rena material och minimal eller ingen förberedelse. Därutöver fungerar Ramanspektroskopi väldigt bra för undersökning av de efterfrågade egenskaperna, vad gäller dess känslighet och kapacitet vid sondering av miniatyrkorn i matriser med hög spatial upplösning. Ett portabelt system användes för att identifiera föroreningar och fingeravtryck av den omslutande bergarten i de flesta undersökta karbonatprov. Den sällsynta karbonaten burbankit visade på distinkta fluorescensband, som sannolikt kan tillskrivas dess komplicerade kemiska sammansättning. Ramansystemet användes i gemmologiskt syfte och kunde identifiera ädelstenarnas renhet. Diamant och två rubiner visade sig sakna föroreningar, men den röda korunden visade en bred topp, som kan indikera på spår av naturlig värmebehandling, som i sin tur kan ha orsakats av regional metamorfos eller till och med en strålningskälla. Därutöver studerades sambandet mellan signalstyrkan hos fluoriters band och mineralers kemiska sammansättning. Experimentet visade att blå fluorit fullständigt saknar toppen från T2g, medan de lila och grå fluoriterna hade välutvecklade och lättigenkännliga toppar vid denna position. Således upptäcktes att denna topps närvaro och intensitet är direkt beroende av fluroritens färg, det vill säga av elementen som är inkorporerade i kristallstrukturen, så som metaller, sällsynta jordartsmetaller eller till och med organiska substanser. Därutöver identifierades restdragspänning i den färglösa kvartsen. Spänningen uppskattades ligga i intervallet 0.23 – 1.0 GPa. Ramansystemet användes för att identifiera olika ändelement i granatfamiljen. Ramanspektroskopin hade hög analytisk förmåga och hjälpte till att estimera förhållandet mellan ändelementen i åtta granatprover. I ett fall kunde fluorescens bindas till förekomsten av sällsynta jordartsmetaller i almandinets struktur. Ett kalcitprov visade sig vara felaktigt placerat i samlingen. Detta arbete kommer nu utgöra en god grund för den mineralogiska samlingens handbok.
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Spectroscopic Identification and Characterization of Gemstone MineralsShad, Farhad Ali January 2021 (has links)
Since last few years, many artificial and modified gemstones are available whose origins are questionable and even an experienced gemmology expert may be unable to differentiate between these artificial gemstones. Raman spectroscopy is considered to be an effective method to differentiate natural and artificial gemstones as it involves a very simple sample preparation, is non-destructive in nature, and is sensitive, precise, and accurate. In the present study, Raman spectroscopy was employed to identify different gemstones available in the mineralogical collection at the Department of Earth Sciences, Uppsala University. Both precious and semiprecious gemstones like quartz, diamond, beryl, corundum, topaz and tourmaline were evaluated with the usage of a portable Raman spectrometer. The major objective of the present study was to characterize these gemstones and to identify their origin, whether these are natural or synthetic materials, by analysing and comparing Raman spectra. Shifts in dominant peak positions and widths(FWHM) for natural and synthetic samples were extracted in the course of fitting procedures and then compared with the RRUFF database. The variations of these parameters, studied both within the same variety of a gemstone, as well as in between different gemstone varieties, were found to be revealing in several ways. For example, it provided information about the internal residual stresses in quartz crystals, and about the instrumental effects on the spectra. Quartz samples of different colors, shapes, and origins (natural/synthetic) were analyzed. It was found that, within the resolution of this study, it would be difficult to differentiate between synthetic and natural non-metamorphic quartz. A higher resolution study, combined with a chemical analysis by electron microprobe, could possibly facilitate such differentiation. On the other hand, a highly-stressed metamorphic environment leaves an imprint in the crystal structure of quartz, which can be recognized by the Raman technique. For beryl varieties of gemstones, the results suggest that the synthetic crystals display slightly lower values of Raman shifts and smaller values of FWHMs as compared to their natura lcounterparts. This could possibly be used as a criterion for distinguishing between these two categories of beryl gemstones. The agreement between Raman spectra of green tourmalines and those of elbaite from the database was very good, justifying the elbaite identification. The strong correlation of peak positions and FWHMs of studied synthetic diamonds reveals that pressure-temperature and chemistry conditions of synthesis leave a distinct imprint on the crystal structure of diamond, thus making Raman spectroscopy a useful technique for investigating the origin of diamonds, for example detecting their laboratory-specific origin.
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