Evidence map›Paper›PMID 38542864›Full record

ArticleMolecules (Basel, Switzerland)2024

Quantum-Chemistry Study of the Hydrolysis Reaction Profile in Borate Networks: A Benchmark.

Francesco Muniz-Miranda, Leonardo Occhi, Francesco Fontanive, Maria Cristina Menziani, Alfonso Pedone

Open access · goldAbstract read
In one paragraph

Article in Molecules (Basel, Switzerland), 2024. 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
0.6field-weighted citation impact, top 33% of its field
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, 2 citations in OpenAlex.

  1. Unveiling the Influence of Water Molecules for NFMolecules (Basel, Switzerland) · 2024
    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 at 1 institution in 1 country.

Francesco Muniz-MirandaDipartimento di Scienze Chimiche e Geologiche (DSCG), Università degli Studi di Modena e Reggio-Emilia (UNIMORE), Via G. Campi 103, 41125 Modena, Italy.ORCID 0000-0002-7614-2326
Leonardo OcchiDipartimento di Scienze Chimiche e Geologiche (DSCG), Università degli Studi di Modena e Reggio-Emilia (UNIMORE), Via G. Campi 103, 41125 Modena, Italy.
Francesco FontaniveDipartimento di Scienze Chimiche e Geologiche (DSCG), Università degli Studi di Modena e Reggio-Emilia (UNIMORE), Via G. Campi 103, 41125 Modena, Italy.ORCID 0009-0000-0021-3258
Maria Cristina MenzianiDipartimento di Scienze Chimiche e Geologiche (DSCG), Università degli Studi di Modena e Reggio-Emilia (UNIMORE), Via G. Campi 103, 41125 Modena, Italy.ORCID 0000-0003-3428-5297
Alfonso PedoneDipartimento di Scienze Chimiche e Geologiche (DSCG), Università degli Studi di Modena e Reggio-Emilia (UNIMORE), Via G. Campi 103, 41125 Modena, Italy.ORCID 0000-0003-3772-7222
University of Modena and Reggio Emilia · IT

Funding

Fondo di dipartimento per la ricerca anno 2022, Linea: progetti di ricerca (FAR2022) of the "Dipartimento di Scienze Chimiche e Geologiche" (DSCG) of the Università degli Studi di Modena e Reggio-Emilia (UNIMORE) FAR2022
6 · The paper itself

Abstract

This investigation involved an ab initio and Density Functional Theory (DFT) analysis of the hydrolysis mechanism and energetics in a borate network. The focus was on understanding how water molecules interact with and disrupt the borate network, an area where the experimental data are scarce and unreliable. The modeled system consisted of two boron atoms, bridging oxygen atoms, and varying numbers of water molecules. This setup allows for an exploration of hydrolysis under different environmental conditions, including the presence of OH

Indexed as

borateDFTglasseshydrolysisMP2

Identifiers

PMID38542864
PMCPMC10975288
OpenAlexW4392659407

What OpenQuestion holds

Textmetadata
LicenceCC BY
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.