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Record W2065710410 · doi:10.1021/jp7113829

Interactions of Na-Salts and 1-Propanol in 1-Propanol−Na-Salt−H<sub>2</sub>O Systems:  Toward an Understanding the Hofmeister Series (IV)

2008· article· en· W2065710410 on OpenAlexaff
K. Miki, Peter Westh, Yoshikata Koga

Bibliographic record

VenueThe Journal of Physical Chemistry B · 2008
Typearticle
Languageen
FieldChemical Engineering
TopicChemical and Physical Properties in Aqueous Solutions
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsHofmeister seriesChaotropic agentChemistryTernary operationThermodynamicsSalt (chemistry)PropanolEnthalpySalting outOsmolyteIonActivity coefficientHydrophobic effectPhysical chemistryAqueous solutionOrganic chemistryMethanol

Abstract

fetched live from OpenAlex

The excess chemical potential of 1-propanol (1P), muE1P, was evaluated in ternary 1P-Na-salt(S)-H2O at 25 degrees C. The counter anions of the Na-salts studied are SO42-, F-, Cl-, I-, and ClO4-. The effect of the anion on muE1P follows the Hofmeister ranking, in that the more kosmotropic ions make the muE1P value more positive. We then evaluate the effect of the Na-salt (S) on muE1P, the 1P-S interaction in terms of excess chemical potential, at a semi-infinite dilution. The results indicate that the 1P-S interaction in terms of excess chemical potential is unfavorable (repulsive) for all of the ions studied. The degree of repulsive interaction decreases in the order of the Hofmeister ranking from the kosmotropic to the chaotropic end. Namely, salting-out samples make the excess part of the chemical potential of 1P more unfavorable, while the salting-in counterparts make it less unfavorable. From earlier calorimetric studies on the same ternary systems, the enthalpic 1P-S interaction function, HE 1P-S , was calculated. Hence, the entropy analogue, S1P-S , was also obtained, and a detailed thermodynamic signature of 1P-S interactions became available. This revealed that both HE 1P-S and SE 1P-S decrease from the kosmotropic ion to the middle of the ranking (Cl-), whereupon they turn to increase toward the chaotropic end. Hence, the build up of unfavorable 1P-S interactions in Hofmeister salts (signified by muE1P) relies on a pronounced enthalpy-entropy compensation, which must be accounted for in attempts to understand the molecular mechanisms underpinning Hofmeister effects.

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 score0.029
Threshold uncertainty score0.567

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 studies0.0000.001
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.001
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 head0.041
GPT teacher head0.242
Teacher spread0.201 · 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

Citations13
Published2008
Admission routes1
Has abstractyes

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