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Dresden 2020 – wissenschaftliches Programm

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CPP: Fachverband Chemische Physik und Polymerphysik

CPP 30: 2D Materials II: Electronic Structure, Excitations, etc. (joint session O/CPP/HL)

CPP 30.12: Vortrag

Montag, 16. März 2020, 18:00–18:15, WIL C107

Theoretical study on the magnetic structure of few-layer TMPS3 — •Tae Yun Kim1,2,3 and Cheol-Hwan Park1,2,31Department of Physics and Astronomy, Seoul National University, Seoul 08826, Korea — 2Gwanak-Gu Hoam-Ro 519 101-1205 — 3Center for Theoretical Physics, Seoul National University, Seoul 08826, Korea

Transition metal phosphorus sulfides (TMPS3) are a family of the layered magnetic materials. Due to the layered structure and the rich spectrum of the magnetic structure [1], TMPS3 has been thought to be a good playground for testing two-dimensional magnetism in real world experiments [2]. It was found that the antiferromagnetic order in FePS3 remains down to the monolayer limit [3, 4], which was soon followed by the discovery of two-dimensional ferromagnetism in CrI3 [5] and Cr2Ge2Te6 [6]. More recently, the existence of the magnetic ordering in few-layer TMPS3 has been investigated in experiments [7, 8]. In this contribution, we present an in-depth investigation of the magnetic structure of few-layer TMPS3 based on the results of our first-principles calculations.

[1] R. Brec, Solid State Ionics 22, 3 (1986).

[2] K. S. Burch et al., Nature 563, 47-52 (2018).

[3] X. Wang et al., 2D Materials 3, 031009 (2016).

[4] J.-U. Lee et al., Nano Letters 16, 7433 (2016).

[5] B. Huang et al., Nature 546, 270-273 (2017).

[6] C. Gong et al., Nature 546, 265-269 (2017).

[7] K. Kim et al., Nature Communications 10, 345 (2019).

[8] K. Kim et al., 2D Materials 6, 041001 (2019).

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