arXiv subjects

Pengpeng Zhang

Publications and source records attributed to Pengpeng Zhang.

16 recordsLinked to original sources

arXiv2026

Dual Charge-Density-Waves in Two-dimensional DyTe3 and Their Distinct Impacts on Magneto-Transport Properties

Charge-density-waves (CDWs) are macroscopic quantum states defined by periodic modulations in electronic charge density coupled with lattice distortions. Despite significant research efforts, the evolution of electromagnetic transport properties in the presence of CDWs remains largely unexplored. Here, we report the effects of two orthogonal CDWs (CDW1 and CDW2) coexisting at low-temperature in DyTe3 on its electronic transport properties. Importantly, we find that while no clear magnetotransport anomaly is resolved across CDW1 transition under the present experimental conditions, the emergence of CDW2 drives a drastic enhancement in magnetoresistance and a multiband-governed nonlinear Hall response. These results demonstrate that CDW1 and CDW2 in DyTe3 are fundamentally different and impact its electronic transport in qualitatively distinct ways, establishing DyTe3 as a model system for understanding the transport consequences of multiple CDWs in quasi-two-dimensional materials.

cond-mat.str-el↗

arXiv2026

ALKEMIE Agent: an autonomous platform for computational materials design

Despite the powerful multi-scale modeling methods and high-throughput infrastructures established in the materials community, real material computation workflows remain fragmented and heavily manual, requiring researchers to constantly bridge software tools, data analysis, and intermediate decisions. This growing gap between methodological capability and practical execution highlights the need for a new kind of autonomous computational framework, one that can coordinate tools, knowledge, and workflows in a more unified and adaptive way. Here, we introduce ALKEMIE Agent, an agentic platform in which retrieval-augmented generation, a materials-computation knowledge base, registered skills, database-supported provenance, AI-assisted structure modeling, bounded task execution, tool-calling iteration, and error-diagnostic assistance are integrated within a traceable control loop. The capabilities of ALKEMIE Agent are demonstrated through applications including materials recommendation, structure modeling, phonon calculations, machine-learned interatomic potential training, LAMMPS simulations, Ab Initio Monte Carlo (AIMC) sampling, and active-learning-based materials screening. Finally, we outline the future directions and challenges for the development of agentic platforms for computational materials design.

cond-mat.mtrl-sci↗

arXiv2026

Angular-Dependent Thermal Hall Effect in a Honeycomb Magnet: Disentangling Kitaev and Dzyaloshinskii-Moriya Interactions

Layered honeycomb magnets have garnered significant attention recently for their exotic quantum phenomena due to the potential anisotropic, bond-dependent Kitaev interactions. However, distinguishing the roles of Kitaev interactions and the symmetry-allowed Dzyaloshinskii-Moriya interaction (DMI) remains challenging, since both mechanisms may lead to similar magnetic excitations and thermal transport properties. To tackle this challenge, using a ferromagnetic honeycomb insulator VI3 as a model system, we systematically study the angular-dependent thermal Hall conductivity Kxy(θ, Φ) with both out-of-plane (θ) and in-plane (Φ) magnetic field rotations. Our results reveal a persistent thermal Hall response for both out-of-plane and in-plane rotating magnetic fields, devoid of the sign-reversal patterns characteristic of Kitaev physics. Instead, quantitative analysis shows that the angular dependent Kxy(θ, Φ) is governed by the projection between the magnetic moment and a tilted DM vector containing both out-of-plane and in-plane components. These results not only establish the DMI-driven topological magnetic excitations as the origin of the thermal Hall response in VI3 but also highlight the angular-dependent thermal Hall effect measurements as an effective approach for distinguishing competing interactions in quantum magnets.

cond-mat.str-el↗

arXiv2025

Large Anomalous and Topological Hall Effect and Nernst Effect in a Dirac Kagome Magnet Fe3Ge

The search for kagome magnets with unconventional magnetic and electronic properties has gained significant attention in recent years. We report the magnetic, electronic, and thermoelectric properties of Fe3Ge single crystals, where the Fe atoms form a slightly distorted kagome lattice. Fe3Ge exhibits a large anomalous Hall effect and anomalous Nernst effect. The anomalous transverse thermoelectric conductivity reaches about 4.6 A m^-1 K^-1, exceeding values reported for conventional ferromagnets and most topological ferromagnets. First-principles calculations indicate that these transport responses are primarily governed by intrinsic mechanisms, highlighting the dominant role of Berry curvature arising from massive Dirac gaps in momentum space. In addition, we observe a topological Hall resistivity of about 0.9 microOhm cm and a topological Nernst coefficient of 1.2 microvolt K^-1, which are attributed to the Berry phase associated with field-induced scalar spin chirality. These findings demonstrate the combined influence of Berry phases in both momentum and real space, establishing Fe3Ge as a promising candidate for room-temperature transverse thermoelectric applications.

cond-mat.mtrl-sci↗

arXiv2025

Language-Guided Long Horizon Manipulation with LLM-based Planning and Visual Perception

Language-guided long-horizon manipulation of deformable objects presents significant challenges due to high degrees of freedom, complex dynamics, and the need for accurate vision-language grounding. In this work, we focus on multi-step cloth folding, a representative deformable-object manipulation task that requires both structured long-horizon planning and fine-grained visual perception. To this end, we propose a unified framework that integrates a Large Language Model (LLM)-based planner, a Vision-Language Model (VLM)-based perception system, and a task execution module. Specifically, the LLM-based planner decomposes high-level language instructions into low-level action primitives, bridging the semantic-execution gap, aligning perception with action, and enhancing generalization. The VLM-based perception module employs a SigLIP2-driven architecture with a bidirectional cross-attention fusion mechanism and weight-decomposed low-rank adaptation (DoRA) fine-tuning to achieve language-conditioned fine-grained visual grounding. Experiments in both simulation and real-world settings demonstrate the method's effectiveness. In simulation, it outperforms state-of-the-art baselines by 2.23, 1.87, and 33.3 on seen instructions, unseen instructions, and unseen tasks, respectively. On a real robot, it robustly executes multi-step folding sequences from language instructions across diverse cloth materials and configurations, demonstrating strong generalization in practical scenarios. Project page: https://language-guided.netlify.app/

cs.RO↗

arXiv2025

Retrieval Augmented Comic Image Generation

We present RaCig, a novel system for generating comic-style image sequences with consistent characters and expressive gestures. RaCig addresses two key challenges: (1) maintaining character identity and costume consistency across frames, and (2) producing diverse and vivid character gestures. Our approach integrates a retrieval-based character assignment module, which aligns characters in textual prompts with reference images, and a regional character injection mechanism that embeds character features into specified image regions. Experimental results demonstrate that RaCig effectively generates engaging comic narratives with coherent characters and dynamic interactions. The source code will be publicly available to support further research in this area.

cs.CV↗

arXiv2024

Giant Nernst Angle in Self-Intercalated van der Waals Magnet Cr$_{1.25}$Te$_2$

The discovery of two-dimensional van der Waals (vdW) magnetic materials has propelled advancements in technological devices. The Nernst effect, which generates a transverse electric voltage in the presence of a longitudinal thermal gradient, shows great promise for thermoelectric applications. In this work, we report the electronic and thermoelectric transport properties of Cr$_{1.25}$Te$_2$, a layered self-intercalated vdW material which exhibits an antiferromagnetic ordering at TN ~ 191 K followed by a ferromagnetic-like phase transition at TC ~171 K. We observe a prominent topological Hall effect and topological Nernst effect between TC and TN, which is ascribable to non-coplanar spin textures inducing a real-space Berry phase due to competing ferromagnetic and antiferromagnetic interactions. Furthermore, we show that Cr$_{1.25}$Te$_2$ exhibits a substantial anomalous Nernst effect, featuring a giant Nernst angle of ~37% near TC and a maximum Nernst thermoelectric coefficient of 0.52 uV/K. These results surpass those of conventional ferromagnets and other two-dimensional vdW materials, highlighting Cr$_{1.25}$Te$_2$ as a promising candidate for advanced thermoelectric devices based on the Nernst effect.

cond-mat.mtrl-sci↗

arXiv2024

Thermal Hall effect in a van der Waals ferromagnet CrI3

CrI3 is a prototypical van der Waals ferromagnet with a magnetic honeycomb lattice. Previous inelastic neutron scattering studies have suggested topological nature of its magnetic excitations with a magnon gap at the Dirac points, which are anticipated to give rise to magnon thermal Hall effect. Here we report thermal transport properties of CrI3 and show that the long-sought thermal Hall signal anticipated for topological magnons is fairly small. In contrast, we find that CrI3 exhibits an appreciable anomalous thermal Hall signal at lower temperature which may arise from magnon-phonon hybridization or magnon-phonon scattering. These findings are anticipated to stimulate further neutron scattering studies on CrI3 single crystal, which can shed light not only on the intrinsic nature of magnetic excitations but also on the magnon-phonon interaction.

cond-mat.mtrl-sci↗

arXiv2024

Distance-Dependent Evolution of Electronic States in Kagome- Honeycomb Lateral Heterostructures in FeSn

In this work, we demonstrate the formation and electronic influence of lateral heterointerfaces in FeSn containing Kagome and honeycomb layers. Lateral heterostructures offer spatially resolved property control, enabling the integration of dissimilar materials and promoting phenomena not typically observed in vertical heterostructures. Using the molecular beam epitaxy technique, we achieve a controllable synthesis of lateral heterostructures in the Kagome metal FeSn. With scanning tunneling microscopy/spectroscopy in conjunction with first-principles calculations, we provide a comprehensive understanding of the bonding motif connecting the Fe3Sn-terminated Kagome and Sn2-terminated honeycomb surfaces. More importantly, we reveal a distance-dependent evolution of the electronic states in the vicinity of the heterointerfaces. This evolution is significantly influenced by the orbital character of the flat bands. Our findings suggest an approach to modulate the electronic properties of the Kagome lattice, which should be beneficial for the development of future quantum devices.

cond-mat.str-el↗

arXiv2023

Thermal Hall effect in a van der Waals triangular magnet FeCl2

Thermal transport is a pivotal probe for studying low-energy, charge-neutral quasi-particles in insulating magnets. In this Letter, we report an observation of large magneto-thermal conductivity and thermal Hall effect (THE) in a van der Waals antiferromagnet FeCl2. The magneto-thermal conductivity reaches over ~700%, indicating strong magnon-phonon coupling. Furthermore, we find an appreciable thermal Hall signal which changes sign concurrently with the spin-flip transition from the antiferromagnetic state to the polarized ferromagnetic state. Our theoretical calculations suggest that, in addition to the Berry curvature induced at the anticrossing points of the hybridized magnon and acoustic phonon modes of FeCl2, other mechanisms are needed to account for the magnitude of the observed THE.

cond-mat.mtrl-sci↗

arXiv2021

Deformation Driven Seq2Seq Longitudinal Tumor and Organs-at-Risk Prediction for Radiotherapy

Purpose: Radiotherapy presents unique challenges and clinical requirements for longitudinal tumor and organ-at-risk (OAR) prediction during treatment. The challenges include tumor inflammation/edema and radiation-induced changes in organ geometry, whereas the clinical requirements demand flexibility in input/output sequence timepoints to update the predictions on rolling basis and the grounding of all predictions in relationship to the pre-treatment imaging information for response and toxicity assessment in adaptive radiotherapy. Methods: To deal with the aforementioned challenges and to comply with the clinical requirements, we present a novel 3D sequence-to-sequence model based on Convolution Long Short Term Memory (ConvLSTM) that makes use of series of deformation vector fields (DVF) between individual timepoints and reference pre-treatment/planning CTs to predict future anatomical deformations and changes in gross tumor volume as well as critical OARs. High-quality DVF training data is created by employing hyper-parameter optimization on the subset of the training data with DICE coefficient and mutual information metric. We validated our model on two radiotherapy datasets: a publicly available head-and-neck dataset (28 patients with manually contoured pre-, mid-, and post-treatment CTs), and an internal non-small cell lung cancer dataset (63 patients with manually contoured planning CT and 6 weekly CBCTs). Results: The use of DVF representation and skip connections overcomes the blurring issue of ConvLSTM prediction with the traditional image representation. The mean and standard deviation of DICE for predictions of lung GTV at week 4, 5, and 6 were 0.83$\pm$0.09, 0.82$\pm$0.08, and 0.81$\pm$0.10, respectively, and for post-treatment ipsilateral and contralateral parotids, were 0.81$\pm$0.06 and 0.85$\pm$0.02.

cs.CV↗

arXiv2021

Multitask 3D CBCT-to-CT Translation and Organs-at-Risk Segmentation Using Physics-Based Data Augmentation

In current clinical practice, noisy and artifact-ridden weekly cone-beam computed tomography (CBCT) images are only used for patient setup during radiotherapy. Treatment planning is done once at the beginning of the treatment using high-quality planning CT (pCT) images and manual contours for organs-at-risk (OARs) structures. If the quality of the weekly CBCT images can be improved while simultaneously segmenting OAR structures, this can provide critical information for adapting radiotherapy mid-treatment as well as for deriving biomarkers for treatment response. Using a novel physics-based data augmentation strategy, we synthesize a large dataset of perfectly/inherently registered planning CT and synthetic-CBCT pairs for locally advanced lung cancer patient cohort, which are then used in a multitask 3D deep learning framework to simultaneously segment and translate real weekly CBCT images to high-quality planning CT-like images. We compared the synthetic CT and OAR segmentations generated by the model to real planning CT and manual OAR segmentations and showed promising results. The real week 1 (baseline) CBCT images which had an average MAE of 162.77 HU compared to pCT images are translated to synthetic CT images that exhibit a drastically improved average MAE of 29.31 HU and average structural similarity of 92% with the pCT images. The average DICE scores of the 3D organs-at-risk segmentations are: lungs 0.96, heart 0.88, spinal cord 0.83 and esophagus 0.66. This approach could allow clinicians to adjust treatment plans using only the routine low-quality CBCT images, potentially improving patient outcomes. Our code, data, and pre-trained models will be made available via our physics-based data augmentation library, Physics-ArX, at https://github.com/nadeemlab/Physics-ArX.

eess.IV↗

arXiv2021

Generalizable Cone Beam CT Esophagus Segmentation Using Physics-Based Data Augmentation

Automated segmentation of esophagus is critical in image guided/adaptive radiotherapy of lung cancer to minimize radiation-induced toxicities such as acute esophagitis. We developed a semantic physics-based data augmentation method for segmenting esophagus in both planning CT (pCT) and cone-beam CT (CBCT) using 3D convolutional neural networks. 191 cases with their pCT and CBCTs from four independent datasets were used to train a modified 3D-Unet architecture with a multi-objective loss function specifically designed for soft-tissue organs such as esophagus. Scatter artifacts and noise were extracted from week 1 CBCTs using power law adaptive histogram equalization method and induced to the corresponding pCT followed by reconstruction using CBCT reconstruction parameters. Moreover, we leverage physics-based artifact induced pCTs to drive the esophagus segmentation in real weekly CBCTs. Segmentations were evaluated using geometric Dice and Hausdorff distance as well as dosimetrically using mean esophagus dose and D5cc. Due to the physics-based data augmentation, our model trained just on the synthetic CBCTs was robust and generalizable enough to also produce state-of-the-art results on the pCTs and CBCTs, achieving 0.81 and 0.74 Dice overlap. Our physics-based data augmentation spans the realistic noise/artifact spectrum across patient CBCT/pCT data and can generalize well across modalities with the potential to improve the accuracy of treatment setup and response analysis.

eess.IV↗

arXiv2019

Cross-modality (CT-MRI) prior augmented deep learning for robust lung tumor segmentation from small MR datasets

Lack of large expert annotated MR datasets makes training deep learning models difficult. Therefore, a cross-modality (MR-CT) deep learning segmentation approach that augments training data using pseudo MR images produced by transforming expert-segmented CT images was developed. Eighty-One T2-weighted MRI scans from 28 patients with non-small cell lung cancers were analyzed. Cross-modality prior encoding the transformation of CT to pseudo MR images resembling T2w MRI was learned as a generative adversarial deep learning model. This model augmented training data arising from 6 expert-segmented T2w MR patient scans with 377 pseudo MRI from non-small cell lung cancer CT patient scans with obtained from the Cancer Imaging Archive. A two-dimensional Unet implemented with batch normalization was trained to segment the tumors from T2w MRI. This method was benchmarked against (a) standard data augmentation and two state-of-the art cross-modality pseudo MR-based augmentation and (b) two segmentation networks. Segmentation accuracy was computed using Dice similarity coefficient (DSC), Hausdroff distance metrics, and volume ratio. The proposed approach produced the lowest statistical variability in the intensity distribution between pseudo and T2w MR images measured as Kullback-Leibler divergence of 0.069. This method produced the highest segmentation accuracy with a DSC of 0.75 and the lowest Hausdroff distance on the test dataset. This approach produced highly similar estimations of tumor growth as an expert (P = 0.37). A novel deep learning MR segmentation was developed that overcomes the limitation of learning robust models from small datasets by leveraging learned cross-modality priors to augment training. The results show the feasibility of the approach and the corresponding improvement over the state-of-the-art methods.

cs.CV↗

arXiv2019

Directed Formation Control of n Planar Agents with Distance and Area Constraints

In this paper, we take a first step towards generalizing a recently proposed method for dealing with the problem of convergence to incorrect equilibrium points of distance-based formation controllers. Specifically, we introduce a distance and area-based scheme for the formation control of $n$-agent systems in two dimensions using directed graphs and the single-integrator model. We show that under certain conditions on the edge lengths of the triangulated desired formation, the control ensures almost-global convergence to the correct formation.

cs.MA↗

arXiv2015

Interfacial Coupling and Electronic Structure of Two-Dimensional Silicon Grown on the Ag(111) Surface at High Temperature

Freestanding silicene, a monolayer of Si arranged in a honeycomb structure, has been predicted to give rise to massless Dirac fermions, akin to graphene. However, Si structures grown on a supporting substrate can show properties that strongly deviate from the freestanding case. Here, combining scanning tunneling microscopy/spectroscopy and differential conductance mapping, we show that the electrical properties of the ($\sqrt{3}\times\sqrt{3}$) phase of few-layer Si grown on Ag(111) strongly depend on film thickness, where the electron phase coherence length decreases and the free-electron-like surface state gradually diminishes when approaching the interface. These features are presumably attributable to the inelastic inter-band electron-electron scattering originating from the overlap between the surface state, interface state and the bulk state of the substrate. We further demonstrate that the intrinsic electronic structure of the as grown ($\sqrt{3}\times\sqrt{3}$) phase is identical to that of the ($\sqrt{3}\times\sqrt{3}$)R$30^{\circ}$ reconstructed Ag on Si(111), both of which exhibit the parabolic energy-momentum dispersion relation with comparable electron effective masses. These findings highlight the essential role of interfacial coupling on the properties of two-dimensional Si structures grown on supporting substrates, which should be thoroughly scrutinized in pursuit of silicene.

cond-mat.mes-hall↗