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    • Research Interests
    Molecular Simulation...Molecular SimulationsMaterials DiscoveryHybrid Density Funct...Hybrid Density FunctionalsDensity-Functional T...Density-Functional TheoryCooperative Reaction...Cooperative Reactions202020172025
    20182024

    Papers共 41 篇Author StatisticsCo-AuthorSimilar Experts

    By YearBy Citation主题筛选期刊级别筛选合作者筛选合作机构筛选
    时间
    引用量
    主题
    期刊级别
    合作者
    合作机构
    All20252024202320222021202020192018
    Overview on Building Blocks and Applications of Efficient and Robust Extended Tight Binding
    Abylay Katbashev,Marcel Stahn, Thomas Rose, Vahideh Alizadeh, Marvin Friede,Christoph Plett,Pit Steinbach,Sebastian Ehlert
    The journal of physical chemistry A (2025)
    Cited0Views0WOSBibtex
    0
    0
    Dxtb-an Efficient and Fully Differentiable Framework for Extended Tight-Binding
    Marvin Friede, Christian Hoelzer,Sebastian Ehlert,Stefan Grimme
    JOURNAL OF CHEMICAL PHYSICSno. 6 (2024)
    Cited0Views3WOSBibtex
    0
    3
    ONIOM Meets Xtb: Efficient, Accurate, and Robust Multi-Layer Simulations Across the Periodic Table
    Christoph Plett, Abylay Katbashev,Sebastian Ehlert,Stefan Grimme,Markus Bursch
    PHYSICAL CHEMISTRY CHEMICAL PHYSICSno. 27 (2023): 17860-17868
    Cited7Views15WOSBibtex
    7
    15
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    Author Statistics
    00.20.40.60.81#Papers#CitationH-IndexG-IndexSociabilityDiversityActivity

    #Papers: 41

    #Citation: 6005

    H-Index: 16

    G-Index: 29

    Sociability: 6

    Diversity: 2

    Activity: 12

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    • 合作者
    • 学生
    • 导师
    Stefan Grimme合作论文数
    Fachgruppe Chemie, Universitat Bonn27
    Christoph Bannwarth合作论文数
    7
    Andreas Hansen合作论文数
    Institut für Physikalische und Theoretische Chemie, Universität Bonn7
    Eike Caldeweyher合作论文数
    R&D IT, AstraZeneca6
    Jan-Michael Mewes合作论文数
    †Interdisciplinary Center for Scientific Computing, Ruprechts-Karls University6
    Brad Richardson合作论文数
    5
    Milan Curcic合作论文数
    Univ Miami, Rosenstiel Sch Marine & Atmospher Sci, Coral Gables, FL 33124 USA5
    Marcel Müller合作论文数
    Clausius-Institut für Physikalische und Theoretische Chemie, Rheinische Friedrich-Wilhelms Universität Bonn5
    Gerhard Erker合作论文数
    Organisch-Chemisches Institut, University of Münster5
    Gerald Kehr合作论文数
    5
    Ondrej Certik合作论文数
    1 Faculty of Mathematics and Physics;Charles University;Faculty of Mathematics and Physics, Charles University5
    Constantin G. Daniliuc合作论文数
    Institut für Anorganische und Analytische Chemie, Techn. University Braunschweig Hagenring 305
    Vincent Magnin合作论文数
    4
    Laurence Kedward合作论文数
    4
    Philipp Pracht合作论文数
    Yusuf Hamied Dept Chem, Univ Cambridge4
    Sebastian Spicher合作论文数
    Univ Bonn, Mulliken Ctr Theoret Chem, D-53115 Bonn, Germany4
    Emanuele Pagone合作论文数
    Cranfield University4
    Hagen Neugebauer合作论文数
    Mulliken Ctr Theoret Chem, Univ Bonn4
    Skoch Karel合作论文数
    4
    Christoph Plett合作论文数
    3
    Markus Bursch合作论文数
    Mulliken Ctr Theoret Chem, Univ Bonn3
    Marcel Stahn合作论文数
    Inst Phys & Theoret Chem, Univ Bonn3
    Ivan Pribec合作论文数
    Faculty of Chemistry and Chemical Technology, University of Ljubljana3
    Aaron D. Kaplan合作论文数
    Temple University3
    Jeremie Vandenplas合作论文数
    Gembloux Agro Bio-Tech, University of Liège3
    Brandenburg Jan Gerit合作论文数
    Institut für Physikalische und Theoretische Chemie, Rheinische Friedrich-Wilhelms Universität Bonn3
    James W. Furness合作论文数
    School of Chemistry, University of Nottingham3
    Frauenheim Thomas合作论文数
    Beijing Computational Science Research Center;Bremen Center for Computational Material Sciences, University of Bremen3
    Jinliang Ning合作论文数
    State Key Laboratory of Metastable Materials Science and Technology, Yanshan University3
    Hermann Jan合作论文数
    Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic3
    Balint Aradi合作论文数
    Theoretische Physik, Universität Paderborn3
    Tim Kowalczyk合作论文数
    3
    Alexandre Tkatchenko合作论文数
    Department of Physics and Materials Science, Faculty of Science, Technology and Communication, University of Luxembourg3
    John Perdew合作论文数
    Department of Physics, College of Science and Technology, Temple University;Center for Materials Theory, Temple University3
    A J Page合作论文数
    2
    M. P. Persson合作论文数
    2
    I. S. Lee合作论文数
    2
    T. van der Heide合作论文数
    2
    Megan Y Deshaye合作论文数
    2
    Caterina Cevallos合作论文数
    2
    Manish Kothakonda合作论文数
    Department of Physics and Engineering Physics, Tulane University2
    Julian J Kranz合作论文数
    Karlsruhe Institute of Technology2
    A. Buccheri合作论文数
    2
    Asdrubal Lozada-Blanco合作论文数
    2
    V Lutsker合作论文数
    2
    Pit Steinbach合作论文数
    2
    Izaac Mitchell合作论文数
    Sch Mat Sci & Engn, Ulsan Natl Inst Sci & Technol2
    Rohit Goswami合作论文数
    Department of Chemistry, Indian Institute of Technology Kanpur2
    M. Sternberg合作论文数
    2
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