Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$

Abstract Nodal loop semimetals are topological materials with drumhead surface states characterized by reduced kinetic energy. If the Fermi energy of such a system is near these nondispersive states interaction among charge carriers substantially impacts their electronic structure. The emergence of...

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Main Authors: Assem Alassaf, János Koltai, Amador García-Fuente, László Oroszlány
Format: Article
Language:English
Published: Nature Portfolio 2024-12-01
Series:Scientific Reports
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Online Access:https://doi.org/10.1038/s41598-024-83168-y
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author Assem Alassaf
János Koltai
Amador García-Fuente
László Oroszlány
author_facet Assem Alassaf
János Koltai
Amador García-Fuente
László Oroszlány
author_sort Assem Alassaf
collection DOAJ
description Abstract Nodal loop semimetals are topological materials with drumhead surface states characterized by reduced kinetic energy. If the Fermi energy of such a system is near these nondispersive states interaction among charge carriers substantially impacts their electronic structure. The emergence of magnetism in these surface states is one of the possible consequences. Ca $$_3$$ P $$_2$$ an already synthesized material possesses a remarkably large nodal loop which is situated exactly at the Fermi level of the bulk system. In the present work, we investigate how surface magnetism is impacted by surface reconstruction and lattice termination in finite slabs in this material. We show that a slight deviation from the stoichiometric occupation of Ca sites results in the stabilization of magnetic patterns.
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spelling doaj-art-18f2ac810f4345e1861fed9d4e141d5f2025-08-20T02:45:57ZengNature PortfolioScientific Reports2045-23222024-12-011411910.1038/s41598-024-83168-ySurface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$Assem Alassaf0János Koltai1Amador García-Fuente2László Oroszlány3Department of Physics of Complex Systems, ELTE Eötvös Loránd UniversityDepartment of Biological Physics, ELTE Eötvös Loránd UniversityDepartamento de Física, Universidad de OviedoDepartment of Physics of Complex Systems, ELTE Eötvös Loránd UniversityAbstract Nodal loop semimetals are topological materials with drumhead surface states characterized by reduced kinetic energy. If the Fermi energy of such a system is near these nondispersive states interaction among charge carriers substantially impacts their electronic structure. The emergence of magnetism in these surface states is one of the possible consequences. Ca $$_3$$ P $$_2$$ an already synthesized material possesses a remarkably large nodal loop which is situated exactly at the Fermi level of the bulk system. In the present work, we investigate how surface magnetism is impacted by surface reconstruction and lattice termination in finite slabs in this material. We show that a slight deviation from the stoichiometric occupation of Ca sites results in the stabilization of magnetic patterns.https://doi.org/10.1038/s41598-024-83168-yNodal loop semimetalsSurface magnetismAb initio
spellingShingle Assem Alassaf
János Koltai
Amador García-Fuente
László Oroszlány
Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
Scientific Reports
Nodal loop semimetals
Surface magnetism
Ab initio
title Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
title_full Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
title_fullStr Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
title_full_unstemmed Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
title_short Surface reconstruction limited magnetism of the nodal loop semimetal Ca $$_3$$ P $$_2$$
title_sort surface reconstruction limited magnetism of the nodal loop semimetal ca 3 p 2
topic Nodal loop semimetals
Surface magnetism
Ab initio
url https://doi.org/10.1038/s41598-024-83168-y
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AT laszlooroszlany surfacereconstructionlimitedmagnetismofthenodalloopsemimetalca3p2