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Record W2136795586 · doi:10.1086/309346

Laboratory Studies of Ion/Molecule Reactions of Fullerenes: Chemical Derivatization of Fullerenes within Dense Interstellar Clouds and Circumstellar Shells

2000· article· en· W2136795586 on OpenAlexaff
Simon Petrie, Diethard K. Böhme

Bibliographic record

VenueThe Astrophysical Journal · 2000
Typearticle
Languageen
FieldChemistry
TopicFullerene Chemistry and Applications
Canadian institutionsYork University
Fundersnot available
KeywordsFullereneAstrochemistryIonFullerene chemistryMoleculeIonizationChemical physicsPhysicsInterstellar mediumPhotochemistryAstrophysicsChemistryGalaxy

Abstract

fetched live from OpenAlex

We discuss recent experimental results for ion/molecule reactions of ionized and multiply-ionized fullerenes, and of derivatized fullerene ions, with molecules relevant to the chemistry of interstellar clouds and circumstellar envelopes These reactions were studied using a selected-ion flow tube (SIFT) at 294 ± 2 K in helium at a pressure of 0.35 ± 0.01 torr. The present study supplements an earlier discussion on aspects of interstellar fullerene ion chemistry explored by the same technique. Several implications are apparent for the chemical processing of fullerenes in various astrophysical environments. Triply charged fullerene ions, such as C 60 3+ , may be formed under conditions prevailing within dense IS clouds, but their abundance will be very low owing to the large number of loss processes identified for such species. Derivatization of fullerene ions under interstellar or circumstellar conditions is less probable for larger fullerenes than for fullerenes smaller than C 60 . Hydrogenation may severely impede the efficiency of fullerene ion association with polar molecules and small unsaturated molecules, but should not substantially affect the efficiency of addition of radicals or PAHs under these conditions. We discuss prospects for neutralization of ionized fullerene adducts. Four classes of adduct ions are described, differing in their structure and expected neutralization tendencies. Adducts of fullerene ions with interstellar isonitriles, with radicals, and with linear polycyclic aromatic hydrocarbons (PAHs; class 1) are most likely to form derivatized fullerenes on neutralization, while fullerene ion adducts of nitriles, most hydrocarbons (class 3), and nonlinear PAHs (class 4) are most likely to yield the bare fullerene cage upon neutralization. Adducts of ammonia (class 2) appear to have an intermediate probability of surviving neutralization with the functionalizing group(s) intact.

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 score0.002
Threshold uncertainty score0.004

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 studies0.0010.001
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0010.000

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 head0.014
GPT teacher head0.243
Teacher spread0.230 · 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

Citations41
Published2000
Admission routes1
Has abstractyes

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