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Record W2012859150 · doi:10.1016/j.ijms.2013.06.022

Decorating (C60)n+, n=1–3, with CO2 at low temperatures: Sterically enhanced physisorption

2013· article· en· W2012859150 on OpenAlexaff
Andreas Mauracher, Alexander Kaiser, Michael Probst, Samuel Zöttl, Matthias Daxner, Johannes Postler, Marcelo Goulart, Fábio Zappa, Diethard K. Böhme, P. Scheier

Bibliographic record

VenueInternational Journal of Mass Spectrometry · 2013
Typearticle
Languageen
FieldPhysics and Astronomy
TopicQuantum, superfluid, helium dynamics
Canadian institutionsYork University
FundersAustrian Science Fund
KeywordsPhysisorptionChemistryTrimerDimerSteric effectsMonomerFullereneCrystallographyComputational chemistryPhotochemistryChemical physicsPhysical chemistryOrganic chemistryPolymer

Abstract

fetched live from OpenAlex

Multiple attachment of CO2 to the monomer, dimer and trimer cations of C60 has been observed in the mass spectra of He nanodroplets sequentially doped with C60 and CO2 and exposed to electron ionization at 50 eV. Remarkable anomalies were seen in the ion yield for CO2 coverage for (C60)2+(CO2)8 and (C60)3+(CO2)1,2. These provide insight into the influence of steric properties on the nature of physisorption. The enhanced stabilities of (C60)2+(CO2)8 and (C60)3+(CO2)1,2 are attributed to physisorption inside the “groove” of the dimer and the two “dimples” in the trimer cations of C60. Molecular dynamics simulations provide a qualitative assessment of the observed physisorption and a useful visualization of structural aspects.

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 categoriesInsufficient payload (model declined to judge)
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 score0.171
Threshold uncertainty score0.999

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 communication0.0000.001
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

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 head0.003
GPT teacher head0.223
Teacher spread0.220 · 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.

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

Citations6
Published2013
Admission routes1
Has abstractyes

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