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Record W1981927263 · doi:10.1021/jp036221j

Determination of Molecular Orientation in Biaxially Oriented Ultrathin Films

2004· article· en· W1981927263 on OpenAlexaff
Isabelle Pelletier, Isabelle Laurin, Thierry Buffeteau, Michel Pézolet

Bibliographic record

VenueThe Journal of Physical Chemistry B · 2004
Typearticle
Languageen
FieldMaterials Science
Topicbiodegradable polymer synthesis and properties
Canadian institutionsUniversité Laval
Fundersnot available
KeywordsMonolayerMaterials scienceTilt (camera)AnisotropyOrientation (vector space)InfraredAmideCrystallographyAzimuthOpticsMolecular physicsChemistryGeometryOrganic chemistryPhysicsNanotechnology

Abstract

fetched live from OpenAlex

Biaxial orientation in ultrathin films is characterized by a preferential orientation of the main molecular axis in the plane of the film in addition to its orientation with respect to the normal of the film. In this paper, analytical expressions allowing the calculation of the molecular orientation in biaxially oriented films from their anisotropic optical constants are presented for the first time. These expressions have been used to calculate the molecular orientation in multilayers of poly(γ-benzyl- l -glutamate) and to determine the angles between the main molecular axis and the different transition moments used (α angles). Using the optical constants determined by Buffeteau et al. 1 for PBG multilayers, we have found that the tilt angle of the PBG helices with respect to the monolayer normal is 89° and that the azimuthal angle in the plane is 57°. The calculated α angles for the carbonyl stretching mode of the ester group and the amide I and amide II modes of the amide group are 49, 34 and 74°, respectively. The analytical expressions presented in this paper have also been used to calculate the molecular orientation in Langmuir−Blodgett monolayers of an equimolar blend of poly( d -lactide) and poly( l -lactide). The optical constants of a monolayer of the polylactide mixture determined using p- and s-polarized transmittance and p-polarized reflection−absorption infrared spectra have shown that the polylactide helices have a tilt angle of 81° and an azimuthal angle of 56°.

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 score0.001
Threshold uncertainty score0.002

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0010.000
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 head0.010
GPT teacher head0.235
Teacher spread0.225 · 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

Citations7
Published2004
Admission routes1
Has abstractyes

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Same venueThe Journal of Physical Chemistry BSame topicbiodegradable polymer synthesis and propertiesFrench-language works237,207