Evidence map›Paper›PMID 40151237›Full record

ArticleJACS Au2025

Molecular Fingerprints of Ice Surfaces in Sum Frequency Generation Spectra: A First-Principles Machine Learning Study.

Margaret L Berrens, Marcos F Calegari Andrade, John T Fourkas, Tuan Anh Pham, Davide Donadio

Abstract read
In one paragraph

Article in JACS Au, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 3 papers.

0numbers the graph read from it
0cells of the map it votes in
3citing 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

3 citing papers in PubMed.

  1. Optical Anisotropy as a Probe of Proton Ordering at Ice Surfaces.Journal of chemical theory and computation · 2026
    Article
  2. Article
  3. 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.

Margaret L BerrensDepartment of Chemistry, University of California Davis, One Shields Ave., Davis, California 95616, United States.
Marcos F Calegari AndradeQuantum Simulations Group, Materials Science Division, Lawrence Livermore National Laboratory, Livermore, California 94550-5507, United States.ORCID https://orcid.org/0000-0001-8630-7393
John T FourkasDepartment of Chemistry and Biochemistry, University of Maryland, College Park, Maryland 20742, United States.ORCID https://orcid.org/0000-0002-4522-9584
Tuan Anh PhamQuantum Simulations Group, Materials Science Division, Lawrence Livermore National Laboratory, Livermore, California 94550-5507, United States.ORCID https://orcid.org/0000-0003-0025-7263
Davide DonadioDepartment of Chemistry, University of California Davis, One Shields Ave., Davis, California 95616, United States.ORCID https://orcid.org/0000-0002-2150-4182

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Understanding the molecular-level structure and dynamics of ice surfaces is crucial for deciphering several chemical, physical, and atmospheric processes. Vibrational sum-frequency generation (SFG) spectroscopy is the most prominent tool for probing the molecular-level structure of the air-ice interface as it is a surface-specific technique, but the molecular interpretation of SFG spectra is challenging. This study utilizes a machine-learning potential, along with dipole and polarizability models trained on

Identifiers

PMID40151237
PMCPMC11938005

What OpenQuestion holds

Textmetadata
LicenceCC BY-NC-ND
Read underepoch 390

Registered trials

None linked

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.