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Record W2995527099 · doi:10.1002/admi.201901707

Dipolar Substitution Impacts Growth and Electronic Properties of <i>Para</i>‐Sexiphenyl Thin Films

2019· article· en· W2995527099 on OpenAlex
Jiaxin Hu, Nabi Aghdassi, Shubham Bhagat, Yves Garmshausen, Rongbin Wang, Norbert Koch, Stefan Hecht, Steffen Duhm, Ingo Salzmann

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.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueAdvanced Materials Interfaces · 2019
Typearticle
Languageen
FieldEngineering
TopicOrganic Electronics and Photovoltaics
Canadian institutionsConcordia University
FundersNational Key Research and Development Program of ChinaNatural Sciences and Engineering Research Council of CanadaConcordia UniversityHigher Education Discipline Innovation ProjectCollaborative Innovation Center of Suzhou Nano Science and TechnologyFonds de recherche du Québec – Nature et technologiesDeutsche Forschungsgemeinschaft
KeywordsMaterials scienceDipoleThin filmX-ray photoelectron spectroscopyIntramolecular forceElectronic structureUltraviolet photoelectron spectroscopyConjugated systemCrystallographyDiffractionRing (chemistry)NanotechnologyComputational chemistryStereochemistryOrganic chemistryNuclear magnetic resonanceOpticsComposite materialChemistryPolymerPhysics

Abstract

fetched live from OpenAlex

Abstract It is shown that fluorination of para ‐sexiphenyl (6P) at the meta ‐ or ortho ‐positions of one terminal phenyl ring, as well as the addition of a terminal cyano‐group has an eminent impact on both growth and electronic properties of thin films. X‐ray diffraction techniques indicate that films of meta ‐substituted 6P ( m ‐2F‐6P) develop a smooth, layered structure showing crystalline order within the layers only. Contrary, both ortho ‐substituted ( o ‐2F‐6P) and cyano‐substituted 6P (CN‐6P) form films of 3D crystalline order. The correlation of structural information with data from ultraviolet photoelectron spectroscopy reveals that m‐2F‐6P and CN‐6P do not show preferentially oriented dipoles in the film, while o ‐2F‐6P grows with collective downward orientation of the dipole moments. The subtle difference in substitution position has a dramatic impact on the thin‐film ionization energy, which increases from 5.40 ( ortho ) to 6.80 eV ( meta ) and reaches even 7.50 eV for CN‐6P. The present study shows that nonsymmetric substitution, which induces molecular dipole moments via intramolecular polar bonds, strongly impacts structure, morphology, and electronic properties of thin films. Thusly modifying common conjugated organic materials represents a valuable tool to establish smooth, crystalline layers with altered energetics at hetero‐interfaces with organic or electrode materials in electronic devices.

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 score0.647

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 head0.006
GPT teacher head0.195
Teacher spread0.189 · 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