Evidence map›Paper›PMID 38959320›Full record

ArticleScience advances2024

Quantifying the regime of thermodynamic control for solid-state reactions during ternary metal oxide synthesis.

Nathan J Szymanski, Young-Woon Byeon, Yingzhi Sun, Yan Zeng, Jianming Bai, Martin Kunz, Dong-Min Kim, Brett A Helms, Christopher J Bartel, Haegyeom Kim and 1 more

Abstract read
In one paragraph

Article in Science advances, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 4 papers.

0numbers the graph read from it
0cells of the map it votes in
4citing 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

4 citing papers in PubMed.

  1. Article
  2. Article
  3. Map of the Zintl AMChemistry of materials : a publication of the American Chemical Society · 2025
    Article
  4. Review
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

11 authors.

Nathan J SzymanskiDepartment of Materials Science and Engineering, UC Berkeley, Berkeley, CA 94720, USA.ORCID 0000-0003-2255-9676
Young-Woon ByeonMaterials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0003-2684-7720
Yingzhi SunDepartment of Materials Science and Engineering, UC Berkeley, Berkeley, CA 94720, USA.ORCID 0000-0003-3559-6863
Yan ZengMaterials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0002-5831-1210
Jianming BaiEnergy and Photon Sciences Directorate, Brookhaven National Laboratory, Upton, NY 11973, USA.ORCID 0000-0002-0575-2987
Martin KunzThe Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0001-9769-9900
Dong-Min KimMolecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0003-0676-8208
Brett A HelmsMolecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0003-3925-4174
Christopher J BartelDepartment of Chemical Engineering and Materials Science, University of Minnesota, Minneapolis, MN 55455, USA.ORCID 0000-0002-5198-5036
Haegyeom KimMaterials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, CA 94720, USA.ORCID 0000-0002-5962-8244
Gerbrand CederDepartment of Materials Science and Engineering, UC Berkeley, Berkeley, CA 94720, USA.ORCID 0000-0001-9275-3605

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

The success of solid-state synthesis often hinges on the first intermediate phase that forms, which determines the remaining driving force to produce the desired target material. Recent work suggests that when reaction energies are large, thermodynamics primarily dictates the initial product formed, regardless of reactant stoichiometry. Here, we validate this principle and quantify its constraints by performing in situ characterization on 37 pairs of reactants. These experiments reveal a threshold for thermodynamic control in solid-state reactions, whereby initial product formation can be predicted when its driving force exceeds that of all other competing phases by ≥60 milli-electron volt per atom. In contrast, when multiple phases have a comparable driving force to form, the initial product is more often determined by kinetic factors. Analysis of the Materials Project data shows that 15% of possible reactions fall within the regime of thermodynamic control, highlighting the opportunity to predict synthesis pathways from first principles.

Identifiers

PMID38959320
PMCPMC11221506

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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.