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Record W4212895345 · doi:10.15278/isms.2021.wh02

FAR-INFRARED AND MICROWAVE SPECTROSCOPY OF HCOOCH<sub>3</sub> II.

2021· article· en· W4212895345 on OpenAlexaffabout
Kaori Kobayashi, Brant Billinghurst, D. W. Tokaryk, Nobukimi Ohashi, Masaharu Fujitake, Akio Itoh

Bibliographic record

VenueProceedings of the 2021 International Symposium on Molecular Spectroscopy · 2021
Typearticle
Languageen
FieldChemistry
TopicMolecular Spectroscopy and Structure
Canadian institutionsCanadian Light Source (Canada)University of New Brunswick
Fundersnot available
KeywordsMicrowaveSpectroscopyInfrared spectroscopyInfraredMaterials sciencePhysicsOptoelectronicsTelecommunicationsComputer scienceOpticsAstronomy

Abstract

fetched live from OpenAlex

The known interstellar molecule, methyl formate (HCOOCH$_3$) has been studied by microwave spectroscopy since 1959 \\footnote{R. F. Curl, \\textit{J. Chem. Phys.} \\underline{\\textbf{30}}, 1529 (1959).}. The laboratory spectra of methyl formate exhibit many unassigned transitions that are \n due to rotational transitions in the low-lying vibrational excited states. The first torsional excited state was reported in 2003 $\\footnote{H. Odashima, K. Ogata, K. Takagi, \\& S. Tsunekawa, \\textit{Molecules} \\underline{\\textbf{8}}, 139 (2003).}$, and up to the second torsional excited state was identified in laboratory and in space. \n$\\footnote{S. Takano, Y. Sakai, S. Kakimoto, M. Sasaki, \\& K. Kobayashi, \\textit{Publ. Astron. Soc. Jpn.} \\underline{\\textbf{64}}, 89 (2012).}$\n$\\footnote{K. Kobayashi, K. Takamura, Y. Sakai, S. Tsunekawa, H. Odashima, \\& N. Ohashi, \\textit{Astrophys. J. Suppl. Ser.} \\underline{\\textbf{205}}, 9 (2013) and references therein.}$ \n \nOur laboratory microwave spectra include a series of unknown $K_a$=0,1 transitions. Based on relative intensities, we estimate that these transitions arise from an excited state about 300 cm$^{-1}$ above the ground state. To facilitate identification, we have taken spectra of methyl formate in the 260-370 cm$^{-1}$ range at Far-Infrared Beamline of the Canadian Light Source synchrotron. The resolution was instrument-limited to 0.00096 cm$^{-1}$. The spectra were very dense, and included the overlapping $\\nu_{12}$ (C-O-C deformation) and $\\nu_{17}$ (C-O torsion) modes. Conventional assignment proved very difficult, so we calculated a-type $K_a$ =0, and 1 rotation-vibration spectra based on the unknown and ground-state microwave data, and gave them arbitrary origins near 300 cm$^{-1}$. By correlating them with the far-infrared spectrum, we were able to determine that the new series correspond to $\\nu_{12}$ near 312 cm$^{-1}$.$\\footnote{K. Kobayashi, Y. Sakai, M. Fujitake, D. W. Tokaryk, B. E. Billinghurst \\& N. Ohashi, \\textit{Can. J. Phys.} \\underline{\\textbf{98}}, 551 (2020).}$ We will report on our assignment technique and results, as well as any further developments we have made in extending the assignments of both the microwave and far-infrared spectra.

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.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation 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 score0.005
Threshold uncertainty score0.017

Distilled classifier scores by category (both heads)

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)0.0050.001

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 head0.003
GPT teacher head0.216
Teacher spread0.213 · 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

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations0
Published2021
Admission routes2
Has abstractyes

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