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G

Gábor Cśanyi

university of cambridge

72H指数
319论文数
2.6W被引数
收录论文 112
发表时间
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Thermal conductivity predictions with foundation atomistic models基于基础原子模型的导热系数预测
errNature Communications
IF15.7
err2026-09-05
err0
errOAAI
errBalázs Póta; Paramvir Ahlawat; Gábor Csányi; Michele Simoncelli
err分享
err收藏
Bottom-Up Synthesis of Molecular Nanodiamond from Nanographene由纳米石墨烯自下而上合成分子纳米金刚石
errNature
IF48.5
err2026-05-26
err0
PREAI
errJiaxu Liang; Christopher P. Ender; Nancy C. Forero-Martinez; Ilyes Batatia; Jingyi Liu; Xin Yang; Raul Gonzalez Brouwer; Lev Kazak; Rémi Blinder; Leonardo Cancellara; Nadezda V. Tarakina; Yizhi Liu; Tobias Eklund; Mangalika Sinha; Sarah Köster; Shrikant Bhat; Fabian Rohmann; Andreas Tangemann; Kilian Lee Gallo; Rüdiger Berger; Robert Farla; Alexander Kubanek; Katrin Amann-Winkel; Manfred Wagner; Fedor Jelezko; Klaus Müllen; Gábor Csányi; Robinson Cortes-Huerto; Yingke Wu; Tanja Weil
err分享
err收藏
Accelerated Reaction Exploration across Scales: A Hybrid Operando and Modeling Study of Oxidation Kinetics in Monolayer Tungsten Disulfide跨尺度加速反应探索：单层二硫化钨氧化动力学研究的混合原位与建模研究
errJournal of the American Chemical Society
IF15.6
err2026-05-20
err0
errOAAI
errJad Jaafar; Ye Fan; Maryam Kazemzadeh-Atoufi; Ryo Mizuta; Jinfeng Yang; Jack E. N. Swallow; Elizabeth Jones; Matthijs Van Spronsen; Georg Held; Robert S. Weatherup; Peter Voorhees; David J. Wales; Gabor Csanyi; Stephan Hofmann
err分享
err收藏
Limitations of Cluster-Trained MLIPs for Liquid Density and Diffusivity集群训练MLIPs在液体密度和扩散率方面的局限性
errJournal of Chemical Theory and Computation
IF5.5
err2026-03-31
err0
errOAAI
errViktor Svahn; Ioan-Bogdan Magdău; Samuel P. Niblett; Gábor Csányi; Kersti Hermansson; Jolla Kullgren
err分享
err收藏
Computing Solvation Free Energies of Small Molecules with Experimental Accuracy
errJournal of the American Chemical Society
IF15.6
err2026-01-27
err0
errOAAI
errJ. Harry Moore; Daniel J. Cole; Gábor Csányi
err分享
err收藏
Clustered Reverse Resumable A* Algorithm for Warehouse Robot Pathfinding集群式反向可恢复A*算法在仓库机器人路径规划中的应用
errMACHINES
IF2.5
err2025-12-08
err0
errOAAI
errCsanyi, Gabor; Laszlo Z., Varga
err分享
err收藏
Towards Routine Condensed Phase Simulations with Delta-Learned Coupled Cluster Accuracy: Application to Liquid Water迈向具有Delta-Learned耦合簇精度的常规凝聚相模拟：液态水的应用
errJournal of Chemical Theory and Computation
IF5.5
err2025-11-07
err0
errOAAI
errNiamh O’Neill; Benjamin X. Shi; William J. Baldwin; William C. Witt; Gábor Csányi; Julian D. Gale; Angelos Michaelides; Christoph Schran
err分享
err收藏
Self-consistent Coulomb interactions for machine learning interatomic potentials自洽库仑相互作用用于机器学习原子间势能
errNONLINEARITY
IF0
err2025-09-30
err0
PREAI
errThomas, Jack; Baldwin, Will; Csanyi, Gabor; Ortner, Christoph
err分享
err收藏
A predictive framework for liquid electrolytes takes root with BAMBOO液体电解质的预测框架扎根于竹子
errNature Machine Intelligence
IF23.9
err2025-07-10
err0
PREAI
errIoan-Bogdan Magdău; Gábor Csányi
err分享
err收藏
Efficient exploration of reaction pathways using reaction databases and active learning
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-03-21
err0
PREAI
errKuryla, Domantas; Csanyi, Gabor; van Duin, Adri C. T.; Michaelides, Angelos
err分享
err收藏
Graph neural networks for strut-based architected solids基于杆件的结构化固体的图神经网络
errJOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS
IF6
err2025-02-01
err0
errOAAI
errGrega, I.; Batatia, I.; Indurkar, P. P.; Csanyi, G.; Karlapati, S.
err分享
err收藏
Data-efficient fine-tuning of foundational models for first-principles quality sublimation enthalpies第一原理质量升华焓的基础模型的数据有效微调
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err2
errOAAI
errKaur, Harveen; Della Pia, Flaviano; Batatia, Ilyes; Advincula, Xavier R.; Shi, Benjamin X.; Lan, Jinggang; Csanyi, Gabor; Michaelides, Angelos; Kapil, Venkat
err分享
err收藏
Efficient Composite Infrared Spectroscopy: Combining the Double-Harmonic Approximation with Machine Learning Potentials
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-12-12
err0
PREAI
errPracht, Philipp; Pillai, Yuthika; Kapil, Venkat; Csanyi, Gabor; Goennheimer, Nils; Vondrak, Martin; Margraf, Johannes T.; Wales, David J.
err分享
err收藏
Setting standards for data driven materials science为数据驱动的材料科学制定标准
errNPJ COMPUTATIONAL MATERIALS
IF11.9
err2024-10-01
err0
errOAAI
errButler, Keith T.; Choudhary, Kamal; Csanyi, Gabor; Ganose, Alex M.; Kalinin, Sergei V.; Morgan, Dane
err分享
err收藏
Accurate Crystal Structure Prediction of New 2D Hybrid Organic-Inorganic Perovskites
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2024-09-30
err0
errOAAI
errKarimitari, Nima; Baldwin, William J.; Muller, Evan W.; Bare, Zachary J. L.; Kennedy, W. Joshua; Csanyi, Gabor; Sutton, Christopher
err分享
err收藏
Guest editorial: Special Topic on software for atomistic machine learning
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-08-09
err1
errOAAI
errRupp, Matthias; Kucukbenli, Emine; Csanyi, Gabor
err分享
err收藏
Benchmarking of machine learning interatomic potentials for reactive hydrogen dynamics at metal surfaces
errMACHINE LEARNING-SCIENCE AND TECHNOLOGY
IF4.6
err2024-07-15
err3
errOAAI
errStark, Wojciech G.; van der Oord, Cas; Batatia, Ilyes; Zhang, Yaolong; Jiang, Bin; Csanyi, Gabor; Maurer, Reinhard J.
err分享
err收藏
Efficiency, accuracy, and transferability of machine learning potentials: to dislocations and cracks in iron
errACTA MATERIALIA
IF9.3
err2024-05-01
err6
errOAAI
errZhang, Lei; Csanyi, Gabor; van der Giessen, Erik; Maresca, Francesco
err分享
err收藏
Toward transferable empirical valence bonds: Making classical force fields reactive
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-03-25
err0
errOAAI
errAllen, Alice E. A.; Csanyi, Gabor
err分享
err收藏
First-principles spectroscopy of aqueous interfaces using machine-learned electronic and quantum nuclear effects
errFARADAY DISCUSSIONS
IF3.1
err2024-01-01
err24
errOAAI
errKapil, Venkat; Kovacs, David Peter; Csanyi, Gabor; Michaelides, Angelos
err分享
err收藏

研究方向

暂无研究方向
合作学者
合作期刊
D
Donald G. Truhlar
H 指数: 187 · 论文数: 1.9K
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刘
刘劼 (Jie Liu)
H 指数: 150 · 论文数: 2.3K
C
Clare P. Grey
H 指数: 132 · 论文数: 1.2K
A
Aron Walsh
H 指数: 126 · 论文数: 984
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