Magnetic Properties of A2Ni2TeO6 (A = K, Li): Zigzag Order in the Honeycomb Layers of Ni2+ Ions Induced by First and Third Nearest-Neighbor Spin Exchanges
The static and dynamic magnetic properties and the specific heat of K2Ni2TeO6 and Li2Ni2TeO6 were examined and it was found that they undergo a long-range ordering at TN = 22.8 and 24.4 K, respectively, but exhibit a strong short-range order. At high temperature, the magnetic susceptibilities of K2N...
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| Published in | Materials Vol. 15; no. 7; p. 2563 |
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| Abstract | The static and dynamic magnetic properties and the specific heat of K2Ni2TeO6 and Li2Ni2TeO6 were examined and it was found that they undergo a long-range ordering at TN = 22.8 and 24.4 K, respectively, but exhibit a strong short-range order. At high temperature, the magnetic susceptibilities of K2Ni2TeO6 and Li2Ni2TeO6 are described by a Curie–Weiss law, with Curie-Weiss temperatures Θ of approximately −13 and −20 K, respectively, leading to the effective magnetic moment of about 4.46 ± 0.01 μB per formula unit, as expected for Ni2+ (S = 1) ions. In the paramagnetic region, the ESR spectra of K2Ni2TeO6 and Li2Ni2TeO6 show a single Lorentzian-shaped line characterized by the isotropic effective g-factor, g = 2.19 ± 0.01. The energy-mapping analysis shows that the honeycomb layers of A2Ni2TeO6 (A = K, Li) and Li3Ni2SbO6 adopt a zigzag order, in which zigzag ferromagnetic chains are antiferromagnetically coupled, because the third nearest-neighbor spin exchanges are strongly antiferromagnetic while the first nearest-neighbor spin exchanges are strongly ferromagnetic, and that adjacent zigzag-ordered honeycomb layers prefer to be ferromagnetically coupled. The short-range order of the zigzag-ordered honeycomb lattices of K2Ni2TeO6 and Li2Ni2TeO6 is equivalent to that of an antiferromagnetic uniform chain, and is related to the short-range order of the ferromagnetic chains along the direction perpendicular to the chains. |
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| AbstractList | The static and dynamic magnetic properties and the specific heat of K2Ni2TeO6 and Li2Ni2TeO6 were examined and it was found that they undergo a long-range ordering at TN = 22.8 and 24.4 K, respectively, but exhibit a strong short-range order. At high temperature, the magnetic susceptibilities of K2Ni2TeO6 and Li2Ni2TeO6 are described by a Curie–Weiss law, with Curie-Weiss temperatures Θ of approximately −13 and −20 K, respectively, leading to the effective magnetic moment of about 4.46 ± 0.01 μB per formula unit, as expected for Ni2+ (S = 1) ions. In the paramagnetic region, the ESR spectra of K2Ni2TeO6 and Li2Ni2TeO6 show a single Lorentzian-shaped line characterized by the isotropic effective g-factor, g = 2.19 ± 0.01. The energy-mapping analysis shows that the honeycomb layers of A2Ni2TeO6 (A = K, Li) and Li3Ni2SbO6 adopt a zigzag order, in which zigzag ferromagnetic chains are antiferromagnetically coupled, because the third nearest-neighbor spin exchanges are strongly antiferromagnetic while the first nearest-neighbor spin exchanges are strongly ferromagnetic, and that adjacent zigzag-ordered honeycomb layers prefer to be ferromagnetically coupled. The short-range order of the zigzag-ordered honeycomb lattices of K2Ni2TeO6 and Li2Ni2TeO6 is equivalent to that of an antiferromagnetic uniform chain, and is related to the short-range order of the ferromagnetic chains along the direction perpendicular to the chains. The static and dynamic magnetic properties and the specific heat of K 2 Ni 2 TeO 6 and Li 2 Ni 2 TeO 6 were examined and it was found that they undergo a long-range ordering at T N = 22.8 and 24.4 K, respectively, but exhibit a strong short-range order. At high temperature, the magnetic susceptibilities of K 2 Ni 2 TeO 6 and Li 2 Ni 2 TeO 6 are described by a Curie–Weiss law, with Curie-Weiss temperatures Θ of approximately −13 and −20 K, respectively, leading to the effective magnetic moment of about 4.46 ± 0.01 μ B per formula unit, as expected for Ni 2+ ( S = 1) ions. In the paramagnetic region, the ESR spectra of K 2 Ni 2 TeO 6 and Li 2 Ni 2 TeO 6 show a single Lorentzian-shaped line characterized by the isotropic effective g -factor, g = 2.19 ± 0.01. The energy-mapping analysis shows that the honeycomb layers of A 2 Ni 2 TeO 6 (A = K, Li) and Li 3 Ni 2 SbO 6 adopt a zigzag order, in which zigzag ferromagnetic chains are antiferromagnetically coupled, because the third nearest-neighbor spin exchanges are strongly antiferromagnetic while the first nearest-neighbor spin exchanges are strongly ferromagnetic, and that adjacent zigzag-ordered honeycomb layers prefer to be ferromagnetically coupled. The short-range order of the zigzag-ordered honeycomb lattices of K 2 Ni 2 TeO 6 and Li 2 Ni 2 TeO 6 is equivalent to that of an antiferromagnetic uniform chain, and is related to the short-range order of the ferromagnetic chains along the direction perpendicular to the chains. |
| Author | Vasiliev, Alexander Lee, Ji-Sun Evstigneeva, Maria Koo, Hyun-Joo Whangbo, Myung-Hwan Vasilchikova, Tatyana Nalbandyan, Vladimir |
| AuthorAffiliation | 3 Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Ekaterinburg 620002, Russia 1 Department of Low Temperature Physics and Superconductivity, Lomonosov Moscow State University, Moscow 119991, Russia; t_vasilchikova@mig.phys.msu.ru 2 Quantum Functional Materials Laboratory, National University of Science and Technology “MISiS”, Moscow 119049, Russia 4 Faculty of Chemistry, Southern Federal University, Rostov-on-Don 344090, Russia; maevstigneeva@gmail.com (M.E.); vbn@sfedu.ru (V.N.) 5 Department of Chemistry and Research Institute for Basic Sciences, Kyung Hee University, Seoul 02447, Korea; ljisun200@khu.ac.kr (J.-S.L.); whangbo@ncsu.edu (M.-H.W.) 6 Department of Chemistry, North Carolina State University, Raleigh, NC 27695, USA |
| AuthorAffiliation_xml | – name: 2 Quantum Functional Materials Laboratory, National University of Science and Technology “MISiS”, Moscow 119049, Russia – name: 5 Department of Chemistry and Research Institute for Basic Sciences, Kyung Hee University, Seoul 02447, Korea; ljisun200@khu.ac.kr (J.-S.L.); whangbo@ncsu.edu (M.-H.W.) – name: 6 Department of Chemistry, North Carolina State University, Raleigh, NC 27695, USA – name: 3 Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Ekaterinburg 620002, Russia – name: 4 Faculty of Chemistry, Southern Federal University, Rostov-on-Don 344090, Russia; maevstigneeva@gmail.com (M.E.); vbn@sfedu.ru (V.N.) – name: 1 Department of Low Temperature Physics and Superconductivity, Lomonosov Moscow State University, Moscow 119991, Russia; t_vasilchikova@mig.phys.msu.ru |
| Author_xml | – sequence: 1 givenname: Tatyana surname: Vasilchikova fullname: Vasilchikova, Tatyana – sequence: 2 givenname: Alexander surname: Vasiliev fullname: Vasiliev, Alexander – sequence: 3 givenname: Maria orcidid: 0000-0002-3646-3774 surname: Evstigneeva fullname: Evstigneeva, Maria – sequence: 4 givenname: Vladimir orcidid: 0000-0002-8624-0165 surname: Nalbandyan fullname: Nalbandyan, Vladimir – sequence: 5 givenname: Ji-Sun surname: Lee fullname: Lee, Ji-Sun – sequence: 6 givenname: Hyun-Joo surname: Koo fullname: Koo, Hyun-Joo – sequence: 7 givenname: Myung-Hwan orcidid: 0000-0002-2220-1124 surname: Whangbo fullname: Whangbo, Myung-Hwan |
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| Snippet | The static and dynamic magnetic properties and the specific heat of K2Ni2TeO6 and Li2Ni2TeO6 were examined and it was found that they undergo a long-range... The static and dynamic magnetic properties and the specific heat of K 2 Ni 2 TeO 6 and Li 2 Ni 2 TeO 6 were examined and it was found that they undergo a... |
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| SubjectTerms | Antiferromagnetism Chains Ferromagnetism first principles calculations High temperature honeycomb lattice Lattices long-range order Magnetic moments Magnetic properties Magnetism metaloxides Potassium Short range order Spin dynamics |
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| Title | Magnetic Properties of A2Ni2TeO6 (A = K, Li): Zigzag Order in the Honeycomb Layers of Ni2+ Ions Induced by First and Third Nearest-Neighbor Spin Exchanges |
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