Spatially modulated orbital-selective ferromagnetism in La5 Co2 Ge3
We present density functional theory calculations for the lowT c metallic ferromagnet La5 Co2 Ge3 at ambient and applied pressures. Our investigations reveal that the system is a quasi-one-dimensional ferromagnet with a peculiar coexistence of two different orbital-selective magnetic moments at two...
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Veröffentlicht in: | Physical review. B 2021-07, Vol.104 (2), p.1 |
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description | We present density functional theory calculations for the lowT c metallic ferromagnet La5 Co2 Ge3 at ambient and applied pressures. Our investigations reveal that the system is a quasi-one-dimensional ferromagnet with a peculiar coexistence of two different orbital-selective magnetic moments at two crystallographically inequivalent cobalt atoms, Co1 and Co2. Namely, due to different crystal-field splitting, the magnetic moment of Co1 atoms predominantly derives from dxz orbital whereas of Co2 atoms from dxy orbital. Consequently, Co1 and Co2 atoms develop unequal net magnetic moments, a feature that gives rise to a periodic, spatial modulation of magnetization along the crystallographic c-direction. The amplitude of the spatial modulation, small at ambient pressure, drastically increases with applied pressure, until Co2 atoms become nonmagnetic. With a help of a toy model mimicking found orbital-selective ferromagnetic order, we demonstrate that the increasing amplitude of spatial modulation provides a consistent interpretation to the recently observed resistivity anomaly emerging at applied pressure identified as the appearance of the new state. Although the proposed here the structural origin of the spatial modulation of magnetic moments in La5Co2 Ge3 is an alternative one to the advocated for this material ferromagnetic quantum criticality avoidance, the effects of quantum fluctuations can still play an important role at pressure larger than up-to-date measured 5 GPa. |
doi_str_mv | 10.1103/PhysRevB.104.024428 |
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Our investigations reveal that the system is a quasi-one-dimensional ferromagnet with a peculiar coexistence of two different orbital-selective magnetic moments at two crystallographically inequivalent cobalt atoms, Co1 and Co2. Namely, due to different crystal-field splitting, the magnetic moment of Co1 atoms predominantly derives from dxz orbital whereas of Co2 atoms from dxy orbital. Consequently, Co1 and Co2 atoms develop unequal net magnetic moments, a feature that gives rise to a periodic, spatial modulation of magnetization along the crystallographic c-direction. The amplitude of the spatial modulation, small at ambient pressure, drastically increases with applied pressure, until Co2 atoms become nonmagnetic. With a help of a toy model mimicking found orbital-selective ferromagnetic order, we demonstrate that the increasing amplitude of spatial modulation provides a consistent interpretation to the recently observed resistivity anomaly emerging at applied pressure identified as the appearance of the new state. Although the proposed here the structural origin of the spatial modulation of magnetic moments in La5Co2 Ge3 is an alternative one to the advocated for this material ferromagnetic quantum criticality avoidance, the effects of quantum fluctuations can still play an important role at pressure larger than up-to-date measured 5 GPa.</description><identifier>ISSN: 2469-9950</identifier><identifier>EISSN: 2469-9969</identifier><identifier>DOI: 10.1103/PhysRevB.104.024428</identifier><language>eng</language><publisher>College Park: American Physical Society</publisher><subject>Amplitudes ; Crystallography ; Density functional theory ; Ferromagnetic materials ; Magnetic moments ; Magnetism ; Modulation ; Pressure</subject><ispartof>Physical review. 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Our investigations reveal that the system is a quasi-one-dimensional ferromagnet with a peculiar coexistence of two different orbital-selective magnetic moments at two crystallographically inequivalent cobalt atoms, Co1 and Co2. Namely, due to different crystal-field splitting, the magnetic moment of Co1 atoms predominantly derives from dxz orbital whereas of Co2 atoms from dxy orbital. Consequently, Co1 and Co2 atoms develop unequal net magnetic moments, a feature that gives rise to a periodic, spatial modulation of magnetization along the crystallographic c-direction. The amplitude of the spatial modulation, small at ambient pressure, drastically increases with applied pressure, until Co2 atoms become nonmagnetic. With a help of a toy model mimicking found orbital-selective ferromagnetic order, we demonstrate that the increasing amplitude of spatial modulation provides a consistent interpretation to the recently observed resistivity anomaly emerging at applied pressure identified as the appearance of the new state. Although the proposed here the structural origin of the spatial modulation of magnetic moments in La5Co2 Ge3 is an alternative one to the advocated for this material ferromagnetic quantum criticality avoidance, the effects of quantum fluctuations can still play an important role at pressure larger than up-to-date measured 5 GPa.</description><subject>Amplitudes</subject><subject>Crystallography</subject><subject>Density functional theory</subject><subject>Ferromagnetic materials</subject><subject>Magnetic moments</subject><subject>Magnetism</subject><subject>Modulation</subject><subject>Pressure</subject><issn>2469-9950</issn><issn>2469-9969</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2021</creationdate><recordtype>article</recordtype><recordid>eNqNik8PwTAcQBshIfgELk2cN7926-jV4s_BQXCXst-odCttJ_HtOYiz03vJe4SMGMSMQTLZXl9-h895zCCNgacpn7VIj6eZjKTMZPvnArpk6P0NAFgGcgqyR_L9XQWtjHnRyhaNUQELat1JB2UijwbPQT-RluicrdSlxqB9RXVNN0rQ3HK6wmRAOqUyHodf9sl4uTjk6-ju7KNBH44327j6k45ciCkXM8az5L_rDTuKQog</recordid><startdate>20210701</startdate><enddate>20210701</enddate><creator>Cuono, Giuseppe</creator><creator>Autieri, Carmine</creator><creator>Wysokiński, Marcin M</creator><general>American Physical Society</general><scope>7SR</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>H8D</scope><scope>JG9</scope><scope>L7M</scope></search><sort><creationdate>20210701</creationdate><title>Spatially modulated orbital-selective ferromagnetism in La5 Co2 Ge3</title><author>Cuono, Giuseppe ; Autieri, Carmine ; Wysokiński, Marcin M</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-proquest_journals_25572581263</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2021</creationdate><topic>Amplitudes</topic><topic>Crystallography</topic><topic>Density functional theory</topic><topic>Ferromagnetic materials</topic><topic>Magnetic moments</topic><topic>Magnetism</topic><topic>Modulation</topic><topic>Pressure</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Cuono, Giuseppe</creatorcontrib><creatorcontrib>Autieri, Carmine</creatorcontrib><creatorcontrib>Wysokiński, Marcin M</creatorcontrib><collection>Engineered Materials Abstracts</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Aerospace Database</collection><collection>Materials Research Database</collection><collection>Advanced Technologies Database with Aerospace</collection><jtitle>Physical review. B</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Cuono, Giuseppe</au><au>Autieri, Carmine</au><au>Wysokiński, Marcin M</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Spatially modulated orbital-selective ferromagnetism in La5 Co2 Ge3</atitle><jtitle>Physical review. B</jtitle><date>2021-07-01</date><risdate>2021</risdate><volume>104</volume><issue>2</issue><spage>1</spage><pages>1-</pages><issn>2469-9950</issn><eissn>2469-9969</eissn><abstract>We present density functional theory calculations for the lowT c metallic ferromagnet La5 Co2 Ge3 at ambient and applied pressures. Our investigations reveal that the system is a quasi-one-dimensional ferromagnet with a peculiar coexistence of two different orbital-selective magnetic moments at two crystallographically inequivalent cobalt atoms, Co1 and Co2. Namely, due to different crystal-field splitting, the magnetic moment of Co1 atoms predominantly derives from dxz orbital whereas of Co2 atoms from dxy orbital. Consequently, Co1 and Co2 atoms develop unequal net magnetic moments, a feature that gives rise to a periodic, spatial modulation of magnetization along the crystallographic c-direction. The amplitude of the spatial modulation, small at ambient pressure, drastically increases with applied pressure, until Co2 atoms become nonmagnetic. With a help of a toy model mimicking found orbital-selective ferromagnetic order, we demonstrate that the increasing amplitude of spatial modulation provides a consistent interpretation to the recently observed resistivity anomaly emerging at applied pressure identified as the appearance of the new state. Although the proposed here the structural origin of the spatial modulation of magnetic moments in La5Co2 Ge3 is an alternative one to the advocated for this material ferromagnetic quantum criticality avoidance, the effects of quantum fluctuations can still play an important role at pressure larger than up-to-date measured 5 GPa.</abstract><cop>College Park</cop><pub>American Physical Society</pub><doi>10.1103/PhysRevB.104.024428</doi></addata></record> |
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title | Spatially modulated orbital-selective ferromagnetism in La5 Co2 Ge3 |
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