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Record W3049696202 · doi:10.1016/j.chemgeo.2020.119819

A Raman spectroscopic tool to estimate chemical composition of natural volcanic glasses

2020· article· en· W3049696202 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.

Bibliographic record

VenueChemical Geology · 2020
Typearticle
Languageen
FieldMaterials Science
TopicGlass properties and applications
Canadian institutionsUniversity of British Columbia
FundersUniversità degli Studi di TorinoUniversità degli Studi di PerugiaLudwig-Maximilians-Universität München
KeywordsRaman spectroscopySilicateMineralogyAnalytical Chemistry (journal)Silicate glassChemical compositionSpectral lineVolcanoGeologyMaterials scienceChemistryGeochemistryOpticsPhysicsEnvironmental chemistry

Abstract

fetched live from OpenAlex

A correlation between Raman spectra of silicate glasses and their chemical composition is investigated using a collection of 31 natural multicomponent silicate glasses. The sample suite comprises the largest database of Raman spectra collected on natural volcanic materials and spans subalkaline to Na-rich and K-rich alkaline compositions. Raman spectra were acquired using a Nd solid state green laser having an excitation wavelength of 532 nm. The model was verified against an independent database of 8 additional samples (i.e. not used for calibration). Ratios of Raman peaks (R, Rn) retrieved from spectra are shown to have a strong covariance with concentrations of six oxides (SiO2, TiO2, Al2O3, FeOT, MgO and CaO) across the compositional range of the sample suite. The Raman ratios are also strongly correlated to pseudo-structural parameters (e.g., NBO/T, SM) calculated from oxide concentrations of SiO2, TiO2, Al2O3, FeOT, MgO, CaO, Na2O and K2O. The Raman ratios are relatively insensitive to variations in Na2O and K2O contents and, as a consequence, their concentrations can only be estimated if additional independent constraints on chemical content are available. This work constitutes the first generalized model for retrieving chemical compositions of natural glasses from corresponding Raman spectra. The model provides a rapid, robust and inexpensive way to retrieve compositions of volcanic glasses in both laboratory and field environments and thus represents a powerful new tool for earth and planetary, archaeological and glass sciences. A similar strategy can be applied to silicate melts and glasses used in industrial activities.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.006
Threshold uncertainty score0.465

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.013
GPT teacher head0.267
Teacher spread0.254 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it