材料科学
Paper Review Records
全部论文审稿周期
11 篇有效样本 · 按发表日期由新到旧排列
审稿天数=录用日期-收稿日期;保留 PDF/DOI/网页源链接
Physics-informed automated surface reconstruction via low-energy electron diffraction based on Bayesian optimization
作者Xiankang Tang; Ruiwen Xie; Jan P. Hofmann; Hongbin Zhang
作者单位1. Theory of Magnetic Materials Group, Department of Materials and Geosciences, Technical University of Darmstadt, Darmstadt, Germany; 2. Surface Science Laboratory, Department of Materials and Geosciences, Technical University of Darmstadt, Darmstadt, Germany
From global optimization to transition state search: an automated workflow for surface reaction barriers
作者Hyunwook Jung; Emanuel Colombi Manzi; Tiago J. Goncalves; Vanessa J. Bukas; Sandip De; Johannes T. Margraf; Karsten Reuter; Hendrik H. Heenen
作者单位1. Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin, Germany; 2. BASF SE, Ludwigshafen, Germany; 3. University of Bayreuth, Bavarian Center for Battery Technology (BayBatt), Bayreuth, Germany
Multiscale modelling of ferroelectrics using a physics-informed neural network driven by molecular dynamics data: parameter identification and field reconstruction
作者Xuejian Wang; Frank Wendler; Hikaru Auzuma; Michael Zaiser; Shuji Ogata; Ryo Kobayashi; Lei Zeng; Xingchen Tan
作者单位1. Department of Materials Science and Engineering, Institute of Materials Simulation, Friedrich-Alexander-Universität Erlangen-Nürnberg, Fürth, Germany; 2. Graduate School of Engineering, Nagoya Institute of Technology, Nagoya, Japan
Vibrational power spectra as a tool to benchmark universal machine-learning interatomic potentials for molecular systems: the OMOL-1k-MD data set
作者Maximilian A. Bechtel; Julien Steffen
作者单位1. Friedrich-Alexander-Universität Erlangen-Nürnberg (FAU), Lehrstuhl für Theoretische Chemie, Erlangen, Germany
Real-time time-dependent density functional theory study of optical Kerr nonlinearities in semiconductors and metals
作者Xiao Chen; Nicolas Tancogne-Dejean; Jingyin Huang; Silvana Botti
作者单位1. Institut für Festkörpertheorie und -optik, Friedrich-Schiller-Universität Jena, Jena, Germany; 2. Research Center for Future Energy Materials and Systems and Interdisciplinary Centre for Advanced Materials Simulation, Faculty of Physics and Astronomy, Ruhr University Bochum, Bochum, Germany; 3. European Theoretical Spectroscopy Facility (ETSF)
Benchmarking universal machine learning interatomic potentials on elemental systems
作者Hossein Tahmasbi; Andreas Knüpfer; Thomas D. Kühne; Hossein Mirhosseini
作者单位1. Center for Advanced Systems Understanding (CASUS), Görlitz, Germany; 2. Helmholtz-Zentrum Dresden-Rossendorf (HZDR), Dresden, Germany
Data-driven transfer learning across MOF-derived zirconia polymorphs
作者David Gryc; Ioannis Kouroudis; Pritam Banerjee; E. Eja Petersen; Qiu Zhuang; Maissa Mansour; Aziz ben Ali; Romy L. Ettlinger; Alessio Gagliardi; Joerg Jinschek; Mian Zahid Hussain
作者单位1. Chair of Inorganic and Metal-Organic Chemistry, Technical University of Munich, Garching, Germany; 2. TUM School of Computation, Information and Technology, Technical University of Munich, Garching, Germany; 3. National Centre for Nano Fabrication and Characterization, Technical University of Denmark, Kongens Lyngby, Denmark
Expert Matching · Case Demo
把投稿要求,转成可验证的期刊方案
说清专业、时限和作者背景,CrushSCI 结合真实审稿样本,给出拟题方向、期刊初筛与周期判断。