Evidence map›Paper›PMID 42806002›Full record

ArticleNature communications2026

Many-body interactions resolve halide distribution at the air/water interface.

H Agnew, R Rashmi, X Zhu, S Dasgupta, F Paesani

Abstract read
In one paragraph

Article in Nature communications, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.

0numbers the graph read from it
0cells of the map it votes in
1citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

1 citing paper in PubMed.

  1. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

5 authors.

H AgnewDepartment of Chemistry, University of California, San Diego, La Jolla, CA, USA. hagnew@ucsd.edu.
R RashmiDepartment of Chemistry, University of California, San Diego, La Jolla, CA, USA.ORCID http://orcid.org/0009-0009-6565-5511
X ZhuDepartment of Chemistry, University of California, San Diego, La Jolla, CA, USA.
S DasguptaDepartment of Chemistry, University of California, San Diego, La Jolla, CA, USA.
F PaesaniDepartment of Chemistry, University of California, San Diego, La Jolla, CA, USA. fpaesani@ucsd.edu.ORCID http://orcid.org/0000-0002-4451-1203

Funding

National Science Foundation (NSF) 2311260
6 · The paper itself

Abstract

Whether dissolved ions approach or avoid the air/water interface remains unsettled, despite its importance for atmospheric and interfacial chemistry. Here we show, using chemically accurate data-driven many-body models and a controlled hierarchy of interaction descriptions, that the intrinsic surface propensity of halide ions depends critically on short-range many-body interactions beyond classical polarization. A conventional polarizable model predicts strong iodide adsorption and weaker stabilization of bromide and chloride. When short-range two- and three-body quantum-mechanical interactions are included, adsorption is strongly suppressed: fluoride, chloride, and bromide remain bulk-favored, while iodide retains only a shallow free-energy minimum comparable to thermal energy. Energy decomposition reveals that iodide's residual preference reflects localized reorganization of interfacial water that offsets the cost of partial dehydration, but is opposed by entropy. These results unify classical electrostatic exclusion and molecular many-body descriptions, showing that halide distributions are controlled not by ion size or polarizability alone, but by a finely balanced collective response of the ion-water system.

Identifiers

PMID42806002
PMCPMC13620159

What OpenQuestion holds

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Registered trials

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.