A Computational Approach for Graphene Doped with N,P,B Structures as Possible Electrode Materials for Potassium Ion Batteries (PIBs): A DFT Investigation.

A Ahmad, A A M Abahussain, M H Nazir, S Z J Zaidi

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In one paragraph

Article in Micromachines, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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5 · Who and what money

Authors and funding

4 authors.

A AhmadInstitute of Chemical Engineering and Technology, University of the Punjab, Lahore 54590, Pakistan.

A A M AbahussainDepartment of Chemical Engineering, King Saud University, P.O. Box 800, Riyadh 11451, Saudi Arabia.

M H NazirFaculty of Computing Engineering and Sciences, University of South Wales, Pontypridd CF37 1DL, UK.

S Z J ZaidiInstitute of Chemical Engineering and Technology, University of the Punjab, Lahore 54590, Pakistan.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Although lithium-ion batteries are considered an ideal postulant for renewable energy harvesting, storage and applications, these batteries show promising performance; however, at the same time, these harvesting devices suffer from some major limitations, including scarce lithium resources, high cost, toxicity and safety concerns. Potassium ion batteries (PIBs) can be proven a favorable alternative to metal ion batteries because of their widespread potassium reserves, low costs and enhanced protection against sparks. In this study, DFT simulations were employed using the B3LYP/6-311

Indexed as

dopingelectronic propertiesgibbs free energygraphenepotassium ion batteries

Identifiers

PMID40731644

DOI10.3390/mi16070735

PMCPMC12299416

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