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Paul Erhart

chalmers university of technology

63H指数
353论文数
1.3W被引数
收录论文 138
发表时间
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NEP89: universal neuroevolution potential for inorganic and organic materials across 89 elementsNEP89：跨越89种元素的通用神经进化势能用于无机和有机材料
errNature Computational Science
IF18.3
err2026-07-08
err0
PREAI
errTing Liang; Ke Xu; Eric Lindgren; Zherui Chen; Rui Zhao; Jiahui Liu; Esmée Berger; Benrui Tang; Bohan Zhang; Yanzhou Wang; Keke Song; Penghua Ying; Nan Xu; Haikuan Dong; Shunda Chen; Paul Erhart; Zheyong Fan; Tapio Ala-Nissila; Jianbin Xu
err分享
err收藏
qNEP: A Highly Efficient Neuroevolution Potential with Dynamic Charges for Large-Scale Atomistic SimulationsqNEP: 一种适用于大规模原子模拟的高效神经进化势能及动态电荷方法
errJournal of Chemical Theory and Computation
IF5.5
err2026-04-20
err0
errOAAI
errZheyong Fan; Benrui Tang; Esmée Berger; Ethan Berger; Erik Fransson; Ke Xu; Zihan Yan; Zhoulin Liu; Zichen Song; Haikuan Dong; Shunda Chen; Lei Li; Ziliang Wang; Yizhou Zhu; Julia Wiktor; Paul Erhart
err分享
err收藏
rhodent: A python package for analyzing real-time TDDFT responserhodent：一个用于分析实时TDDFT响应的Python软件包
errComputer Physics Communications
IF3.4
err2026-02-01
err0
errOAAI
errFojt, Jakub; Rossi, Tuomas P.; Erhart, Paul
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err收藏
A morphotropic phase boundary in MA1−xFAxPbI3: linking structure, dynamics, and electronic propertiesMA1−xFAxPbI3中的形变相界：连接结构、动力学和电子性质
errNature Communications
IF15.7
err2025-10-02
err0
errOAAI
errTobias Hainer; Erik Fransson; Sangita Dutta; Julia Wiktor; Paul Erhart
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err收藏
MUMOTT: a Python package for the analysis of multi-modal tensor tomography dataMUMOTT：一个用于多模态张量层析成像数据分析的Python软件包
errJOURNAL OF APPLIED CRYSTALLOGRAPHY
IF2.8
err2025-10-01
err0
errOAAI
errNielsen, Leonard C.; Carlsen, Mads; Wang, Sici; Baroni, Arthur; Tanzer, Torne; Liebi, Marianne; Erhart, Paul
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Predicting neutron experiments from first principles: a workflow powered by machine learning基于第一性原理的神经实验预测：一种由机器学习驱动的流程
errJ. Mater. Chem. A
IF9.5
err2025-08-05
err0
errOAAI
errEric Lindgren; Adam J. Jackson; Erik Fransson; Esmée Berger; Goran Škoro; Svemir Rudić; Rastislav Turanyi; Sanghamitra Mukhopadhyay; Paul Erhart
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Dynasor 2: From simulation to experiment through correlation functions动态相关函数 2：通过相关函数从模拟到实验
errComputer Physics Communications
IF3.4
err2025-07-18
err0
errOAAI
errEsmée Berger; Erik Fransson; Fredrik Eriksson; Eric Lindgren; Göran Wahnström; Thomas Holm Rod; Paul Erhart
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Untangling the Raman spectra of cubic and tetragonal BaZrO3
errPHYSICAL REVIEW B
IF3.7
err2025-02-18
err1
errOAAI
errRosander, Petter; Fransson, Erik; Osterbacka, Nicklas; Erhart, Paul; Wahnstrom, Goran
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Highly efficient path-integral molecular dynamics simulations with GPUMD using neuroevolution potentials: Case studies on thermal properties of materials使用神经进化势的GPUMD高效路径积分分子动力学模拟: 材料热特性的案例研究
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-02-12
err1
errOAAI
errYing, Penghua; Zhou, Wenjiang; Svensson, Lucas; Berger, Esmee; Fransson, Erik; Eriksson, Fredrik; Xu, Ke; Liang, Ting; Xu, Jianbin; Song, Bai; Chen, Shunda; Erhart, Paul; Fan, Zheyong
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Accelerating Plasmonic Hydrogen Sensors for Inert Gas Environments by Transformer-Based Deep Learning基于Transformer深度学习加速惰性气体环境下的等离激元氢气传感器
errACS SENSORS
IF9.1
err2025-01-07
err2
errOAAI
errMartvall, Viktor; Moberg, Henrik Klein; Theodoridis, Athanasios; Tomecek, David; Ekborg-Tanner, Pernilla; Nilsson, Sara; Volpe, Giovanni; Erhart, Paul; Langhammer, Christoph
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General-purpose machine-learned potential for 16 elemental metals and their alloys
errNATURE COMMUNICATIONS
IF15.7
err2024-11-25
err1
errOAAI
errSong, Keke; Zhao, Rui; Liu, Jiahui; Wang, Yanzhou; Lindgren, Eric; Wang, Yong; Chen, Shunda; Xu, Ke; Liang, Ting; Ying, Penghua; Xu, Nan; Zhao, Zhiqiang; Shi, Jiuyang; Wang, Junjie; Lyu, Shuang; Zeng, Zezhu; Liang, Shirong; Dong, Haikuan; Sun, Ligang; Chen, Yue; Zhang, Zhuhua; Guo, Wanlin; Qian, Ping; Sun, Jian; Erhart, Paul; Ala-Nissila, Tapio; Su, Yanjing; Fan, Zheyong
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Controlling Plasmonic Catalysis via Strong Coupling with Electromagnetic Resonators通过与电磁谐振器的强耦合控制等离子体催化
errNANO LETTERS
IF9.1
err2024-09-12
err0
errOAAI
errFojt, Jakub; Erhart, Paul; Schafer, Christian
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Machine Learning-Based Interpretation of Optical Properties of Colloidal Gold with Convolutional Neural Networks
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2024-08-08
err0
errOAAI
errBilen, Frida; Ekborg-Tanner, Pernilla; Balzano, Antoine; Ughetto, Michael; da Silva, Robson Rosa; Schomaker, Hannes; Erhart, Paul; Moth-Poulsen, Kasper; Bordes, Romain
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Impact of Organic Spacers and Dimensionality on Templating of Halide Perovskites
errACS ENERGY LETTERS
IF18.2
err2024-07-18
err0
errOAAI
errFransson, Erik; Wiktor, Julia; Erhart, Paul
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Origin of Macroscopic Observables of Strongly Coupled Metal Nanoparticle-Molecule Systems from Microscopic Electronic Properties
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2024-06-05
err1
errOAAI
errBancerek, Maria; Fojt, Jakub; Erhart, Paul; Antosiewicz, Tomasz J.
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Tensorial Properties via the Neuroevolution Potential Framework: Fast Simulation of Infrared and Raman Spectra
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-04-04
err9
errOAAI
errXu, Nan; Rosander, Petter; Scha''fer, Christian; Lindgren, Eric; O''sterbacka, Nicklas; Fang, Mandi; Chen, Wei; He, Yi; Fan, Zheyong; Erhart, Paul
err分享
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Phonon-Bottleneck Enhanced Exciton Emission in 2D Perovskites
errADVANCED ENERGY MATERIALS
IF26
err2024-03-15
err1
errOAAI
errThompson, Joshua J. P.; Dyksik, Mateusz; Peksa, Paulina; Posmyk, Katarzyna; Joki, Ambjoern; Perea-Causin, Raul; Erhart, Paul; Baranowski, Michal; Loi, Maria Antonietta; Plochocka, Paulina; Malic, Ermin
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GPAW: An open Python package for electronic structure calculationsGPAW: 一个用于电子结构计算的开放Python包
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-03-07
err58
errOAAI
errMortensen, Jens Jorgen; Larsen, Ask Hjorth; Kuisma, Mikael; Ivanov, Aleksei V.; Taghizadeh, Alireza; Peterson, Andrew; Haldar, Anubhab; Dohn, Asmus Ougaard; Schafer, Christian; Jonsson, Elvar Orn; Hermes, Eric D.; Nilsson, Fredrik Andreas; Kastlunger, Georg; Levi, Gianluca; Jonsson, Hannes; Hakkinen, Hannu; Fojt, Jakub; Kangsabanik, Jiban; Sodequist, Joachim; Lehtomaki, Jouko; Heske, Julian; Enkovaara, Jussi; Winther, Kirsten Trostrup; Dulak, Marcin; Melander, Marko M.; Ovesen, Martin; Louhivuori, Martti; Walter, Michael; Gjerding, Morten; Lopez-Acevedo, Olga; Erhart, Paul; Warmbier, Robert; Wuerdemann, Rolf; Kaappa, Sami; Latini, Simone; Boland, Tara Maria; Bligaard, Thomas; Skovhus, Thorbjorn; Susi, Toma; Maxson, Tristan; Rossi, Tuomas; Chen, Xi; Schmerwitz, Yorick Leonard A.; Schiotz, Jakob; Olsen, Thomas; Jacobsen, Karsten Wedel; Thygesen, Kristian Sommer
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Tailoring Hot-Carrier Distributions of Plasmonic Nanostructures through Surface Alloying通过表面合金化定制等离子体纳米结构的热载流子分布
errACS NANO
IF16
err2024-02-16
err4
errOAAI
errFojt, Jakub; Rossi, Tuomas P.; Kumar, Priyank V.; Erhart, Paul
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Machine Learning for Polaritonic Chemistry: Accessing Chemical Kinetics
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2024-02-14
err9
errOAAI
errSchafer, Christian; Fojt, Jakub; Lindgren, Eric; Erhart, Paul
err分享
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研究方向

暂无研究方向
合作学者
合作期刊
O
Olle Inganäs
H 指数: 119 · 论文数: 676
M
M. Ughetto
H 指数: 119 · 论文数: 918
L
Lars Hultman
H 指数: 116 · 论文数: 999
M
Marc A. Meyers
H 指数: 111 · 论文数: 684
T
Thomas D. Anthopoulos
H 指数: 105 · 论文数: 660
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