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Changwon Park

Publications and source records attributed to Changwon Park.

12 recordsLinked to original sources
arXiv2025

Super Moir\'e Domain Tessellations, Sliding Ferroelectricity, and Reconfigurable Quantum Dot Arrays in Twisted Trilayer Hexagonal Boron Nitride

At very small twist angles, bilayer moir\'e systems exhibit characteristic stacking domain patterns, where the moir\'e length scale is determined solely by the twist angle. In contrast, the additional stacking and twisting degrees of freedom in twisted trilayer systems give rise to richer and more intricate domain tessellations. In twisted trilayer hexagonal boron nitride (TTBN), the interplay between polar and nonpolar domains and their domain walls is shown to result in unconventional responses to external electric fields, including electric-field tunability of the moir\'e-of-moir\'e or super moir\'e pattern--features absent in bilayer counterparts. We demonstrate that at the vertices of super moir\'e domains, TTBN can support arrays of quantum dots hosting localized quantum harmonic oscillator (QHO) states with diverse spatial symmetries. Futhermore, we show that the shape of the array and the spacing between the localized QHO states can be dynamically reconfigured by electric fields, enabling facile switching between fully isolated and strongly coupled regimes. The local potentials for the quantum dot state are predicted to be sufficiently deep to support a series of QHO states with nonzero angular momentum. This tunability enables control over the transport of quantum dot states and their interdot coupling, facillitating long-range quantum state transfer. Combined with the feasibility of large-scale fabrication of homogeneous twisted trilayer materials, these properties position TTBN as a promising platform for a wide range of quantum technologies.

cond-mat.mes-hall↗
arXiv2024

Unconventional domain tessellations in moir\'e-of-moir\'e lattices

Imposing incommensurable periodicity on the periodic atomic lattice can lead to complex structural phases consisting of locally periodic structure bounded by topological defects. Twisted trilayer graphene (TTG) is an ideal material platform to study the interplay between different atomic periodicities, which can be tuned by twist angles between the layers, leading to moir\'e-of-moir\'e lattices. Interlayer and intralayer interactions between two interfaces in TTG transform this moir\'e-of-moir\'e lattice into an intricate network of domain structures at small twist angles, which can harbor exotic electronic behaviors. Here we report a complete structural phase diagram of TTG with atomic scale lattice reconstruction. Using transmission electron microscopy combined with a new interatomic potential simulation, we show several large-scale moir\'e lattices, including triangular, kagome, and a corner-shared hexagram-shaped domain pattern. Each domain is bounded by a two-dimensional network of domain wall lattices. In the limit of small twist angles, two competing structural orders-rhombohedral and Bernal stackings-with a slight energy difference, cause unconventional lattice reconstruction with spontaneous symmetry breaking and nematic instability, highlighting the importance of long-range interlayer interactions across entire van der Waals layers. The diverse tessellation of distinct domains, whose topological network can be tuned by the adjustment of the twist angles, establishes TTG as a platform for exploring the interplay between emerging quantum properties and controllable nontrivial lattices.

cond-mat.mtrl-sci↗
arXiv2023

Condensation of preformed charge density waves in kagome metals

Charge density wave (CDW) is a spontaneous spatial modulation of electric charges in solids whose general microscopic descriptions are yet to be completed. Layered kagome metals of $A$V$_3$Sb$_5$ ($A$ = K, Rb, Cs) provide a unique chance to realize its emergence intertwined with dimensional effects as well as their special lattice. Here, based on a state-of-the-art molecular dynamics simulation, we uncover that the phase transition to charge ordered states in kagome metals is a condensation process of incoherently preformed CDWs. We demonstrate that charge modulation first preforms on each kagome layer at a well defined temperature but its phase fluctuation proliferates across the entire layers with a $10^5$ times slower frequency than typical phonon vibrations until reaching its freezing temperature. We find that the fluctuation is not random but confined to a limited number of states as a consequence of unavoidable degeneracy in stacking layered charge orders. As the size of interfacial alkali atom increases, the fluctuating phases are shown to counterbalance the condensation of orderings, resulting in a maximized transition temperature for RbV$_3$Sb$_5$. Our results resolve several controversial observations on their CDW formations and highlight a crucial role of interlayer interactions for the charge ordering in kagome metals.

cond-mat.mtrl-sci↗
arXiv2022

Interatomic potential theory on the phase transition of charge density wave in transition metal dichalcogenides

Patterns and periods of charge density waves (CDW) in transition metal dichalcogenides exhibit complex phase diagrams that depend on pressure, temperature, metal intercalation, or chalcogen alloying. The phase diagrams have been understood in the context of phenomenological Landau free energy model, but the microscopic mechanisms underlying them are still not clear. Here, we present a new microscopic theory based on the interatomic potential, and have explicitly calculated temperature-dependent phase diagrams using the interatomic potential extracted from first-principles calculations. With detailed atomic structures, the calculated phase diagram of monolayer H-TaSe2 successfully reproduces the experimental features such as commensurate lock-in and stripe phase. Our work shows the complex behaviors of charge density wave are originated from the relatively simple structure of the interatomic potential and elucidates the role of lattice anharmonicity on the CDW phase transition.

cond-mat.mtrl-sci↗
arXiv2020

Charge density wave with anomalous temperature dependence in UPt2Si2

Using single crystal neutron and x-ray diffraction, we discovered a charge density wave (CDW) below 320 K, which accounts for the long-sought origin of the heat capacity and resistivity anomalies in UPt2Si2. The modulation wavevector, Qmod, is intriguingly similar to the Fermi surface nesting wavevector of URu2Si2. Qmod shows an unusual temperature dependence, shifting from commensurate to incommensurate position upon cooling and becoming locked at ~ (0.42 0 0) near 180 K. Bulk measurements indicate a cross-over toward a correlated coherent state around the same temperature, suggesting an interplay between the CDW and Kondo-lattice-like coherence before coexisting antiferromagnetic order sets in at TN = 35 K.

cond-mat.supr-con↗
arXiv2015

Electronic properties of bilayer graphenes strongly coupled to interlayer stacking and an external electric field

Bilayer graphene (BLG) with a tunable bandgap appears interesting as an alternative to graphene for practical applications, thus its transport properties are being actively pursued. Using density functional theory and perturbation analysis, we investigated, under an external electric field, the electronic properties of BLGs in various stackings relevant to recently observed complex structures. We established the first phase diagram summarizing the stacking-dependent gap openings of BLGs for a given field. We further identified high-density midgap states, localized on grain boundaries, even under a strong field, which can considerably reduce overall transport gap.

cond-mat.mtrl-sci↗
arXiv2014

Interlayer coupling enhancement in graphene/hexagonal boron nitride heterostructures by intercalated defects and vacancies

Among two-dimensional atomic crystals, hexagonal boron nitride (hBN) is one of the most remarkable materials to fabricate heterostructures revealing unusual properties. We perform first-principles calculations to determine whether intercalated metal atoms and vacancies can mediate interfacial coupling and influence the structural and electronic properties of the graphene/hBN heterostructure. Metal impurity atoms (Li, K, Cr, Mn, Co, and Cu) as extrinsic defects between the graphene and hBN sheets produce $n$-doped graphene. We also consider intrinsic vacancy defects and find that a boron monovacancy in hBN act as a magnetic dopant for graphene whereas a nitrogen monovacancy in hBN serves as a nonmagnetic dopant for graphene. In contrast, smallest triangular vacancy defects in hBN are unlikely to result in significant changes in the electronic transport of graphene. Our findings reveal that the hBN layer with some vacancies or metal impurities enhance the interlayer coupling in the graphene/hBN heterostructure with respect to charge doping and electron scattering.

cond-mat.mes-hall↗
arXiv2013

Decay behavior of localized states at reconstructed armchair graphene edges

Density functional theory calculations are used to investigate the electronic structures of localized states at reconstructed armchair graphene edges. We consider graphene nanoribbons with two different edge types and obtain the energy band structures and charge densities of the edge states. By examining the imaginary part of the wavevector in the forbidden energy region, we reveal the decay behavior of the wavefunctions in graphene. The complex band structures of graphene in the armchair and zigzag directions are presented in both tight-binding and first-principles frameworks.

cond-mat.mes-hall↗
arXiv2011

Pseudospin rotation and valley mixing in electron scattering at graphene edges

In graphene, the pseudospin and the valley flavor arise as new types of quantum degrees of freedom due to the honeycomb lattice comprising two sublattices (A and B) and two inequivalent Dirac points (K and K') in the Brillouin zone, respectively. Unique electronic properties of graphene result in striking phenomena such as Klein tunnelling, Veselago lens, and valley-polarized currents. Here, we investigate the roles of the pseudospin and the valley in electron scattering at graphene edges and show that they are strongly correlated with charge density modulations of short-wavelength oscillations and slowly-decaying beat patterns. Theoretical analyses using nearest-neighbor tight-binding methods and first-principles density-functional theory calculations agree well with our experimental data from the scanning tunneling microscopy. We believe that this study will lead to useful application of graphene to "valleytronics" and "pseudospintronics".

cond-mat.mes-hall↗
arXiv2010

Dissociation of ssDNA - Single-Walled Carbon Nanotube Hybrids by Watson-Crick Base Pairing

The unwrapping event of ssDNA from the SWNT during the Watson-Crick base paring is investigated through electrical and optical methods, and binding energy calculations. While the ssDNA-metallic SWNT hybrid shows the p-type semiconducting property, the hybridization product recovered metallic properties. The gel electrophoresis directly verifies the result of wrapping and unwrapping events which was also reflected to the Raman shifts. Our molecular dynamics simulations and binding energy calculations provide atomistic description for the pathway to this phenomenon. This nano-physical phenomenon will open up a new approach for nano-bio sensing of specific sequences with the advantages of efficient particle-based recognition, no labeling, and direct electrical detection which can be easily realized into a microfluidic chip format.

cond-mat.mes-hall↗
arXiv2010

Controlling Half-Metallicity of Graphene Nanoribbons by Using a Ferroelectric Polymer

On the basis of first-principles computational approaches, we present a new method to drive zigzag graphene nanoribons (ZGNRs) into the half-metallic state using a ferroelectric material, poly(vinylidene fluoride) (PVDF). Owing to strong dipole moments of PVDFs, the ground state of the ZGNR becomes half-metallic when a critical coverage of PVDFs is achieved on the ZGNR. Since ferroelectric polymers are physisorbed, the direction of the dipole field in PVDFs can be rotated by relatively small external electric fields, and the switching between half-metallic and insulating states may be achieved. Our results suggest that, without excessively large external gate electric fields, half-metallic states of ZGNRs are realizable through the deposition of ferroelectric polymers and their electronic and magnetic properties are controllable via noninvasive mutual interactions.

cond-mat.mes-hall↗