Electronic origin of the reorganization energy in interfacial electron transfer

Kavli Affiliate: David T. Limmer | First 5 Authors: Sonal Maroo, Leonardo Coello Escalante, Yizhe Wang, Matthew P. Erodici, Jonathon N. Nessralla | Summary: The activation free energy of electron transfer (ET) reactions is governed by a crucial parameter: the reorganization energy. In heterogeneous ET at electrified solid-liquid interfaces, it is presumed that only factors […]


Continue.. Electronic origin of the reorganization energy in interfacial electron transfer

Beyond real: Alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers

Kavli Affiliate: Birgitta Whaley | First 5 Authors: Nikolay V. Tkachenko, Hang Ren, Wendy M. Billings, Rebecca Tomann, K. Birgitta Whaley | Summary: Near-term quantum devices require wavefunction ans"atze that are expressive while also of shallow circuit depth in order to both accurately and efficiently simulate molecular electronic structure. While unitary coupled cluster (e.g., UCCSD) […]


Continue.. Beyond real: Alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers

Beyond real: Alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers

Kavli Affiliate: Birgitta Whaley | First 5 Authors: Nikolay V. Tkachenko, Hang Ren, Wendy M. Billings, Rebecca Tomann, K. Birgitta Whaley | Summary: Near-term quantum devices require wavefunction ans"atze that are expressive while also of shallow circuit depth in order to both accurately and efficiently simulate molecular electronic structure. While unitary coupled cluster (e.g., UCCSD) […]


Continue.. Beyond real: Alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers

Differentiable NMS via Sinkhorn Matching for End-to-End Fabric Defect Detection

Kavli Affiliate: Feng Wang | First 5 Authors: Zhengyang Lu, Bingjie Lu, Weifan Wang, Feng Wang, | Summary: Fabric defect detection confronts two fundamental challenges. First, conventional non-maximum suppression disrupts gradient flow, which hinders genuine end-to-end learning. Second, acquiring pixel-level annotations at industrial scale is prohibitively costly. Addressing these limitations, we propose a differentiable NMS […]


Continue.. Differentiable NMS via Sinkhorn Matching for End-to-End Fabric Defect Detection

SmartTrap: Automated Precision Experiments with Optical Tweezers

Kavli Affiliate: Carlos Bustamante | First 5 Authors: Martin Selin, Antonio Ciarlo, Giuseppe Pesce, Lars Bengtsson, Joan Camunas-Soler | Summary: There is a trend in research towards more automation using smart systems powered by artificial intelligence. While experiments are often challenging to automate, they can greatly benefit from automation by reducing labor and increasing reproducibility. […]


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Lay-Your-Scene: Natural Scene Layout Generation with Diffusion Transformers

Kavli Affiliate: Xiang Zhang | First 5 Authors: Divyansh Srivastava, Xiang Zhang, He Wen, Chenru Wen, Zhuowen Tu | Summary: We present Lay-Your-Scene (shorthand LayouSyn), a novel text-to-layout generation pipeline for natural scenes. Prior scene layout generation methods are either closed-vocabulary or use proprietary large language models for open-vocabulary generation, limiting their modeling capabilities and […]


Continue.. Lay-Your-Scene: Natural Scene Layout Generation with Diffusion Transformers

MeshGen: Generating PBR Textured Mesh with Render-Enhanced Auto-Encoder and Generative Data Augmentation

Kavli Affiliate: Feng Wang | First 5 Authors: Zilong Chen, Yikai Wang, Wenqiang Sun, Feng Wang, Yiwen Chen | Summary: In this paper, we introduce MeshGen, an advanced image-to-3D pipeline that generates high-quality 3D meshes with detailed geometry and physically based rendering (PBR) textures. Addressing the challenges faced by existing 3D native diffusion models, such […]


Continue.. MeshGen: Generating PBR Textured Mesh with Render-Enhanced Auto-Encoder and Generative Data Augmentation

DexCtrl: Towards Sim-to-Real Dexterity with Adaptive Controller Learning

Kavli Affiliate: Xiang Zhang | First 5 Authors: Shuqi Zhao, Ke Yang, Yuxin Chen, Chenran Li, Yichen Xie | Summary: Dexterous manipulation has seen remarkable progress in recent years, with policies capable of executing many complex and contact-rich tasks in simulation. However, transferring these policies from simulation to real world remains a significant challenge. One […]


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Practical approaches for crystal structure predictions with inpainting generation and universal interatomic potentials

Kavli Affiliate: Kristin A. Persson | First 5 Authors: Peichen Zhong, Xinzhe Dai, Bowen Deng, Gerbrand Ceder, Kristin A. Persson | Summary: We present Crystal Host-Guided Generation (CHGGen), a diffusion-based framework for crystal structure prediction. Unconditional generation with diffusion models demonstrates limited efficacy in identifying symmetric crystals as the unit cell size increases. CHGGen addresses […]


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BAROC: Concealing Packet Losses in LSNs with Bimodal Behavior Awareness for Livecast Ingestion

Kavli Affiliate: Feng Wang | First 5 Authors: Haoyuan Zhao, Jianxin Shi, Guanzhen Wu, Hao Fang, Yi Ching Chou | Summary: The advent of Low-Earth Orbit satellite networks (LSNs), exemplified by initiatives like emph{Starlink}, emph{OneWeb} and emph{Kuiper}, has ushered in a new era of “Internet from Space" global connectivity. Recent studies have shown that LSNs […]


Continue.. BAROC: Concealing Packet Losses in LSNs with Bimodal Behavior Awareness for Livecast Ingestion