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X-ray photoelectron and infrared spectroscopies of quartz samples of contrasting toxicity.

ABSTRACT: An exploratory XPS and FTIR investigation of the surfaces of bulk quartz powders widely used in toxicological studies (DQ12 and Min-U-Sil 5) was carried with the aim of correlating surface features with toxicity as reflected by indicators of biological response. Some patches of amorphous silica were identified as well as varying amounts of calcium but none of these features correlated with biological response. No evidence of widely-quoted surface silanol (SiOH) structures was found in this investigation and the possibility that FTIR artefacts have been previously misidentified as silanol structures is discussed.

SUBMITTER: Francis SM

PROVIDER: S-EPMC2796500 | biostudies-literature | 2009 Dec

REPOSITORIES: biostudies-literature

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X-ray photoelectron and infrared spectroscopies of quartz samples of contrasting toxicity.

Francis Stephen M SM Stephens W Edryd WE Richardson Neville V NV

Environmental health : a global access science source 20091221

An exploratory XPS and FTIR investigation of the surfaces of bulk quartz powders widely used in toxicological studies (DQ12 and Min-U-Sil 5) was carried with the aim of correlating surface features with toxicity as reflected by indicators of biological response. Some patches of amorphous silica were identified as well as varying amounts of calcium but none of these features correlated with biological response. No evidence of widely-quoted surface silanol (SiOH) structures was found in this inves ...[more]

PMID: 20102589

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Project description:Quartz is the most abundant mineral on the earth's surface. It is spectrally active in the longwave infrared (LWIR) region with no significant spectral features in the optical domain, i.e., visible-near-infrared-shortwave-infrared (Vis-NIR-SWIR) region. Several space agencies are planning to mount optical image spectrometers in space, with one of their missions being to map raw materials. However, these sensors are active across the optical region, making the spectral identification of quartz mineral problematic. This study demonstrates that indirect relationships between the optical and LWIR regions (where quartz is spectrally dominant) can be used to assess quartz content spectrally using solely the optical region. To achieve this, we made use of the legacy Israeli soil spectral library, which characterizes arid and semiarid soils through comprehensive chemical and mineral analyses along with spectral measurements across the Vis-NIR-SWIR region (reflectance) and LWIR region (emissivity). Recently, a Soil Quartz Clay Mineral Index (SQCMI) was developed using mineral-related emissivity features to determine the content of quartz, relative to clay minerals, in the soil. The SQCMI was highly and significantly correlated with the Vis-NIR-SWIR spectral region (R2 = 0.82, root mean square error (RMSE) = 0.01, ratio of performance to deviation (RPD) = 2.34), whereas direct estimation of the quartz content using a gradient-boosting algorithm against the Vis-NIR-SWIR region provided poor results (R2 = 0.45, RMSE = 15.63, RPD = 1.32). Moreover, estimation of the SQCMI value was even more accurate when only the 2000-2450 nm spectral range (atmospheric window) was used (R2 = 0.9, RMSE = 0.005, RPD = 1.95). These results suggest that reflectance data across the 2000-2450 nm spectral region can be used to estimate quartz content, relative to clay minerals in the soil satisfactorily using hyperspectral remote sensing means.

Dataset Information

X-ray photoelectron and infrared spectroscopies of quartz samples of contrasting toxicity.

Publications

X-ray photoelectron and infrared spectroscopies of quartz samples of contrasting toxicity.

Similar Datasets

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