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Andrew J. Medford

georgia institute of technology

44H指数
167论文数
1.1W被引数
收录论文 80
发表时间
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Replacing Quantum Chemistry With Machine-Learned Interatomic Potentials: Revolution or Evolution?用机器学习原子间势能取代量子化学：革命还是进化？
errACS Central Science
IF10.4
err2026-06-23
err0
errOAAI
errAndrew J. Medford; David S. Sholl
err分享
err收藏
Modeling Batch Crystallization under Uncertainty Using Physics-Informed Machine Learning利用物理信息机器学习方法对不确定性条件下的批次结晶过程进行建模
errIndustrial & Engineering Chemistry Research
IF0
err2026-05-01
err0
errOAAI
errDingqi Nai; Huayu Li; Martha A. Grover; Andrew J. Medford
err分享
err收藏
Prospects for using artificial intelligence to understand intrinsic kinetics of heterogeneous catalytic reactions人工智能在理解多相催化反应固有动力学中的应用前景
errCurrent Opinion in Chemical Engineering
IF6.8
err2026-02-17
err0
errOAAI
errAndrew J Medford; Todd N Whittaker; Bjarne Kreitz; David W Flaherty; John R Kitchin
err分享
err收藏
Boron-tuned tetrahedral Co(II) sites in zeolite beta enhance propane dehydrogenation沸石β中硼调制的四面体Co(II)位点增强了丙烷脱氢反应
errApplied Catalysis B: Environment and Energy
IF0
err2025-10-14
err0
errOAAI
errYounhwa Kim; Huston Locht; Andrew J. Medford; Christopher W. Jones
err分享
err收藏
D-MOPH-25: diverse MOF-molecule pairs for Henry's constants prediction*D-MOPH-25：用于亨利常数预测的多样化MOF-分子对*
errMACHINE LEARNING-SCIENCE AND TECHNOLOGY
IF4.6
err2025-09-30
err0
PREAI
errChoi, Sihoon; Sholl, David S.; Medford, Andrew J.
err分享
err收藏
Comparing Classical and Machine Learning Force Fields for Modeling Deformation of Metal-Organic Frameworks Relevant for Direct Air Capture比较经典机器学习力场在直接空气捕获相关金属有机框架变形建模中的应用
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2025-09-01
err2
errOAAI
errBrabson, Logan M.; Medford, Andrew J.; Sholl, David S.
err分享
err收藏
Rational design of selective catalysts for ethylene hydroformylation via microkinetic modeling and universal neural network potentials乙烯氢甲酰化选择性催化剂的理性设计：通过微观动力学建模和通用神经网络势能
errJournal of Catalysis
IF6.5
err2025-05-29
err0
PREAI
errKento Sakai; Ippei Furikado; Andrew J. Medford
err分享
err收藏
Spectral scheme for atomic structure calculations in density functional theory密度泛函理论中原子结构计算的光谱方案
errCOMPUTER PHYSICS COMMUNICATIONS
IF3.4
err2025-03-01
err0
PREAI
errBhowmik, Sayan; Pask, John E.; Medford, Andrew J.; Suryanarayana, Phanish
err分享
err收藏
Innovative Approach to Sustainable Fertilizer Production: Leveraging Electrically Assisted Conversion of Sewage Sludge for Nutrient Recovery
errACS OMEGA
IF4.3
err2024-12-07
err0
PREAI
errBotte, Gerardine G.; Donneys-Victoria, Dayana; Alvarez-Pugliese, Christian E.; Adjei, Jedidian; Sahin, Selin; Wilson, Nathan W.; Millerick, Kayleigh; Hardberger, Amy; Furst, Ariel L.; Hu, Nicole; Medford, Andrew J.
err分享
err收藏
Evaluating the Role of Metastable Surfaces in Mechanochemical Reduction of Molybdenum Oxide
errJACS AU
IF8.7
err2024-11-19
err0
errOAAI
errYu, Neung-Kyung; Rasteiro, LeticiaF.; Nguyen, Van Son; Golabek, Kinga M.; Sievers, Carsten; Medford, Andrew J.
err分享
err收藏
Benchmarking photocatalysts for dinitrogen photoreduction reaction
errCHEM CATALYSIS
IF11.6
err2024-10-01
err0
PREAI
errHuang, Po-Wei; Haro, Danae A. Chipoco; Song, Hakhyeon; Medford, Andrew J.; Hatzell, Marta C.
err分享
err收藏
Overcoming the Chemical Complexity Bottleneck in on-the-Fly Machine Learned Molecular Dynamics Simulations
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-07-08
err0
errOAAI
errTimmerman, Lucas R.; Kumar, Shashikant; Suryanarayana, Phanish; Medford, Andrew J.
err分享
err收藏
Assessing Exchange-Correlation Functionals for Heterogeneous Catalysis of Nitrogen Species
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2024-07-01
err2
errOAAI
errKim, Honghui; Yu, Neung-Kyung; Tian, Nianhan; Medford, Andrew J.
err分享
err收藏
Electrocatalysts for Inorganic and Organic Waste Nitrogen Conversion
errACS CATALYSIS
IF13.1
err2024-06-14
err5
errOAAI
errHaro, Danae A. Chipoco; Barrera, Luisa; Iriawan, Haldrian; Herzog, Antonia; Tian, Nianhan; Medford, Andrew J.; Shao-Horn, Yang; Alamgir, Faisal M.; Hatzell, Marta C.
err分享
err收藏
The Open DAC 2023 Dataset and Challenges for Sorbent Discovery in Direct Air Capture
errACS CENTRAL SCIENCE
IF10.4
err2024-05-01
err9
errOAAI
errSriram, Anuroop; Choi, Sihoon; Yu, Xiaohan; Brabson, Logan M.; Das, Abhishek; Ulissi, Zachary; Uyttendaele, Matt; Medford, Andrew J.; Sholl, David S.
err分享
err收藏
Model-Based Design of Experiments for Temporal Analysis of Products (TAP): A Simulated Case Study in Oxidative Propane Dehydrogenation
errINDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH
IF3.9
err2024-03-11
err2
errOAAI
errYonge, Adam; Gusmao, Gabriel S.; Fushimi, Rebecca; Medford, Andrew J.
err分享
err收藏
Impact of Local Microenvironments on the Selectivity of Electrocatalytic Nitrate Reduction in a BPM-MEA System
errADVANCED ENERGY MATERIALS
IF26
err2024-02-19
err10
errOAAI
errHuang, Po-Wei; Song, Hakhyeon; Yoo, Jaeyoung; Haro, Danae A. Chipoco; Lee, Hyuck Mo; Medford, Andrew J.; Hatzell, Marta C.
err分享
err收藏
2023 roadmap on ammonia as a carbon-free fuel
errJOURNAL OF PHYSICS-ENERGY
IF6.3
err2024-02-06
err11
errOAAI
errDavid, William I. F.; Agnew, Gerry D.; Banares-Alcantara, Rene; Barth, James; Hansen, John Bogild; Brequigny, Pierre; de Joannon, Mara; Stott, Sofia Furstenberg; Stott, Conor Furstenberg; Guati-Rojo, Andrea; Hatzell, Marta; Macfarlane, Douglas R.; Makepeace, Joshua W.; Mastorakos, Epaminondas; Mauss, Fabian; Medford, Andrew; Mounaim-Rousselle, Christine; Nowicki, Duncan A.; Picciani, Mark A.; Postma, Rolf S.; Rouwenhorst, Kevin H. R.; Sabia, Pino; Salmon, Nicholas; Simonov, Alexandr N.; Smith, Collin; Torrente-Murciano, Laura; Valera-Medina, Agustin
err分享
err收藏
Maximum-likelihood estimators in physics-informed neural networks for high-dimensional inverse problems
errCOMPUTERS & CHEMICAL ENGINEERING
IF3.9
err2024-02-01
err4
errOAAI
errGusmao, Gabriel S.; Medford, Andrew J.
err分享
err收藏
Micro-kinetic modeling of temporal analysis of products data using kinetics-informed neural networks
errDIGITAL DISCOVERY
IF5.6
err2024-01-01
err0
errOAAI
errNai, Dingqi; Gusmao, Gabriel S.; Kilwein, Zachary A.; Boukouvala, Fani; Medford, Andrew J.
err分享
err收藏

研究方向

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合作学者
合作期刊
J
Jens K. Nørskov
H 指数: 221 · 论文数: 892
C
Christoph J. Brabec
H 指数: 149 · 论文数: 1.2K
Y
Yang Shao‐Horn
H 指数: 137 · 论文数: 793
D
Douglas R. MacFarlane
H 指数: 136 · 论文数: 1.2K
汪
汪洋 (Ye Wang)
H 指数: 124 · 论文数: 1.2K
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