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Record W2048322550 · doi:10.1021/jp000025k

A Determination of the Bond Dissociation Energy (<i>D</i><sub>0</sub>(H−SH)):  Threshold Ion-Pair Production Spectroscopy (TIPPS) of a Triatomic Molecule

2000· article· en· W2048322550 on OpenAlexaff
R. C. Shiell, X. K. Hu, Qichi Hu, J. W. Hepburn

Bibliographic record

VenueThe Journal of Physical Chemistry A · 2000
Typearticle
Languageen
FieldChemistry
TopicMass Spectrometry Techniques and Applications
Canadian institutionsUniversity of Waterloo
Fundersnot available
KeywordsTriatomic moleculeChemistryDissociation (chemistry)Polyatomic ionAtomic physicsIonMoleculeSpectroscopyBond-dissociation energyFragmentation (computing)Diatomic moleculePhotodissociationExcitationPhysicsPhotochemistryPhysical chemistry

Abstract

fetched live from OpenAlex

We present the first threshold ion-pair production spectrum of a triatomic molecule. We have recorded the ion-pair yield spectrum and TIPP spectrum for the H 2 S → H + +SH - ion-pair channel using single-photon excitation. From the TIPP spectrum, we have determined the H−SH bond energy (31451 ± 4 cm -1 ) to unprecedented accuracy and demonstrated the formation of weakly bound H + −SH - ( J ‘) ion-pair states, with rotational excitation of the SH - anion up to J ‘ = 4. The bound nature of these states, and the assigned spectrum that results from their field dissociation suggests that this technique can be applied to many other triatomic and larger polyatomic molecules in the future, leading to energetic, spectroscopic, and dynamical information about these species.

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 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 score0.007
Threshold uncertainty score0.423

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 head0.005
GPT teacher head0.229
Teacher spread0.224 · 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 teacher head, 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

Citations84
Published2000
Admission routes1
Has abstractyes

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