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Record W2054917364 · doi:10.1021/jp040295t

Toward Understanding the Hofmeister Series. 1. Effects of Sodium Salts of Some Anions on the Molecular Organization of H<sub>2</sub>O

2004· article· en· W2054917364 on OpenAlex

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.

Bibliographic record

VenueThe Journal of Physical Chemistry A · 2004
Typearticle
Languageen
FieldChemical Engineering
TopicThermodynamic properties of mixtures
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsChemistryHofmeister seriesHydrogen bondHydrateSalt (chemistry)Aqueous solutionEnthalpyMoleculeIonSolvation shellSodiumDegree (music)Inorganic chemistryCrystallographySolvationPhysical chemistryThermodynamicsOrganic chemistry

Abstract

fetched live from OpenAlex

We studied a detailed thermodynamic behavior of 1-propanol (abbreviated as 1P) in mixed solvents of aqueous Na 2 SO 4, NaOOCCH 3, and NaClO 4, and NaSCN. We measured the excess partial molar enthalpy of 1P, H 1P E, in these mixed solvents at various initial salt concentrations. We then evaluated what we call the enthalpic interaction, H 1P - 1P E = (∂ H 1P E /∂ n 1P ), where n 1P is the amount of 1P. The composition dependence of H 1P - 1P E changes in a characteristic manner on addition of a specific salt. This induced change in the behavior of H 1P - 1P E is used to elucidate the effect of the salt on the molecular organization of H 2 O. Na + ion seems to hydrate a number less than seven or eight molecules of H 2 O, leaving the bulk H 2 O outside the hydration shell unperturbed. SO 4 2- also hydrates a number less than 26 H 2 O molecules with a concomitant increase in the degree of fluctuation of the bulk H 2 O. Na 2 SO 4 as a whole hydrates the total of 26 H 2 O. CH 3 COO - ion modifies H 2 O in a similar manner as an alcohol. Cl - ion hydrates a number less than seven or eight H 2 O molecules leaving the bulk H 2 O in the same state as in pure H 2 O. NaCl as a whole hydrates the total of seven or eight molecules of H 2 O. ClO 4 - and SCN - participate in hydrogen bonding with the hydrogen bond network of H 2 O keeping its connectivity intact. However, they reduce the degree of fluctuation inherent in liquid H 2 O. Thus, each ion has its own unique manner of modifying H 2 O, except that ClO 4 - and SCN - modify H 2 O in almost the same way. Therefore, it seems fair to state that the phenomenological net result manifested as the Hofmeister series is due to multifacetted factors working in the holistic manner, and a single or a small number of parameters is not sufficient to explain its effect.

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 score0.021
Threshold uncertainty score0.300

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 science0.0010.000
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 head0.008
GPT teacher head0.188
Teacher spread0.180 · 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