Evidence map›Paper›PMID 41696257›Full record

ArticleACS omega2026

Mechanical Stability and Binder Interaction in MOF Composites: An Integrated Experimental and DFT Study.

Flávia H Silva, Mateus A M Paiva, Inna M Nangoi, Maria Eduarda T Lima, Talita V F da Silva, Leonã S Flores, Raphael B Menezes, Charlane C Corrêa, Alexandre A Leitão

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In one paragraph

Article in ACS omega, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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

0 citing papers in PubMed.

No citing paper in PubMed yet.

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

9 authors.

Flávia H SilvaGPQMAP: Grupo de Pesquisa em Química dos Materiais Porosos, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.
Mateus A M PaivaGFQSI: Grupo de Físico-Química de Sólidos e Interfaces, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.ORCID https://orcid.org/0000-0003-1581-0324
Inna M NangoiGFQSI: Grupo de Físico-Química de Sólidos e Interfaces, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.ORCID https://orcid.org/0000-0003-0074-3712
Maria Eduarda T LimaGPQMAP: Grupo de Pesquisa em Química dos Materiais Porosos, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.
Talita V F da SilvaGPQMAP: Grupo de Pesquisa em Química dos Materiais Porosos, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.
Leonã S FloresGPQMAP: Grupo de Pesquisa em Química dos Materiais Porosos, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.
Raphael B MenezesPETROBRAS-CENPES, Cidade Universitária, Ilha do Fundão, Rio de Janeiro-RJ 21941-915, Brazil.
Charlane C CorrêaGPQMAP: Grupo de Pesquisa em Química dos Materiais Porosos, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.
Alexandre A LeitãoGFQSI: Grupo de Físico-Química de Sólidos e Interfaces, Departamento de Química, Universidade Federal de Juiz de Fora (UFJF), Juiz de Fora-MG 36036-900, Brazil.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

An integrated study combining experimental methods and DFT simulations was undertaken to investigate the binder/MOF composites. The findings demonstrate a strong correlation between the crush strength and surface adsorption energy of methylcellulose (MC) on HKUST, ZIF-8, UiO-66-(Zr), and MIL-53-(Al)-TDC surfaces. Experimental thermogravimetric data and compressive strength measurements, combined with simulated adsorption energies, bond distances, and charge distributions, supported this relationship. DFT calculations of adsorption energy and structural analysis showed that MC/HKUST and MC/ZIF-8 composites exhibit stronger interactions with MC, consistent with their higher mechanical strength at higher temperatures. In contrast, MC/UiO-66-(Zr) and MC/MIL-53-(Al)-TDC presented weaker interactions and lower resistance under thermal stress. This study demonstrates that computational methods, when integrated with experimental techniques, can offer valuable insights into the design of mechanically stable binder/MOF composites.

Identifiers

PMID41696257
PMCPMC12902986

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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.