Hasil Pencarian - Stefano Curtarolo

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  1. 1
    Reformulation of DFT+U as a Pseudohybrid Hubbard Density Functional for Accelerated Materials Discovery

    Reformulation of DFT+U as a Pseudohybrid Hubbard Density Functional for Accelerated Materials Discovery oleh Luis A. Agapito, Stefano Curtarolo, Marco Buongiorno Nardelli

    Diterbitkan 2015-01-01
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  2. 2
    Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling

    Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling oleh Jesús Carrete, Wu Li, Natalio Mingo, Shidong Wang, Stefano Curtarolo

    Diterbitkan 2014-02-01
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  3. 3
    Assessing the Thermoelectric Properties of Sintered Compounds via High-Throughput Ab-Initio Calculations

    Assessing the Thermoelectric Properties of Sintered Compounds via High-Throughput Ab-Initio Calculations oleh Shidong Wang, Zhao Wang, Wahyu Setyawan, Natalio Mingo, Stefano Curtarolo

    Diterbitkan 2011-11-01
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  4. 4
    High-Throughput Computation of Thermal Conductivity of High-Temperature Solid Phases: The Case of Oxide and Fluoride Perovskites

    High-Throughput Computation of Thermal Conductivity of High-Temperature Solid Phases: The Case of Oxide and Fluoride Perovskites oleh Ambroise van Roekeghem, Jesús Carrete, Corey Oses, Stefano Curtarolo, Natalio Mingo

    Diterbitkan 2016-12-01
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  5. 5
    Comprehensive Search for New Phases and Compounds in Binary Alloy Systems Based on Platinum-Group Metals, Using a Computational First-Principles Approach

    Comprehensive Search for New Phases and Compounds in Binary Alloy Systems Based on Platinum-Group Metals, Using a Computational First-Principles Approach oleh Gus L. W. Hart, Stefano Curtarolo, Thaddeus B. Massalski, Ohad Levy

    Diterbitkan 2013-12-01
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  6. 6
    Two-Layer High-Throughput: Effective Mass Calculations Including Warping

    Two-Layer High-Throughput: Effective Mass Calculations Including Warping oleh Andrew Supka, Nicholas A. Mecholsky, Marco Buongiorno Nardelli, Stefano Curtarolo, Marco Fornari

    Diterbitkan 2022-03-01
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  7. 7
    Universal fragment descriptors for predicting properties of inorganic crystals

    Universal fragment descriptors for predicting properties of inorganic crystals oleh Olexandr Isayev, Corey Oses, Cormac Toher, Eric Gossett, Stefano Curtarolo, Alexander Tropsha

    Diterbitkan 2017-06-01
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  8. 8
    High-Throughput Computational Search for Half-Metallic Oxides

    High-Throughput Computational Search for Half-Metallic Oxides oleh Laalitha S. I. Liyanage, Jagoda Sławińska, Priya Gopal, Stefano Curtarolo, Marco Fornari, Marco Buongiorno Nardelli

    Diterbitkan 2020-04-01
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  9. 9
    Theoretical prediction of high melting temperature for a Mo–Ru–Ta–W HCP multiprincipal element alloy

    Theoretical prediction of high melting temperature for a Mo–Ru–Ta–W HCP multiprincipal element alloy oleh Qi-Jun Hong, Jan Schroers, Douglas Hofmann, Stefano Curtarolo, Mark Asta, Axel van de Walle

    Diterbitkan 2021-01-01
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  10. 10
    Plasmonic high-entropy carbides

    Plasmonic high-entropy carbides oleh Arrigo Calzolari, Corey Oses, Cormac Toher, Marco Esters, Xiomara Campilongo, Sergei P. Stepanoff, Douglas E. Wolfe, Stefano Curtarolo

    Diterbitkan 2022-10-01
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  11. 11
    AFLOW-XtalFinder: a reliable choice to identify crystalline prototype

    AFLOW-XtalFinder: a reliable choice to identify crystalline prototype oleh David Hicks, Cormac Toher, Denise C. Ford, Frisco Rose, Carlo De Santo, Ohad Levy, Michael J. Mehl, Stefano Curtarolo

    Diterbitkan 2021-02-01
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  12. 12
    High-entropy high-hardness metal carbides discovered by entropy descriptors

    High-entropy high-hardness metal carbides discovered by entropy descriptors oleh Pranab Sarker, Tyler Harrington, Cormac Toher, Corey Oses, Mojtaba Samiee, Jon-Paul Maria, Donald W. Brenner, Kenneth S. Vecchio, Stefano Curtarolo

    Diterbitkan 2018-11-01
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  13. 13
    Materials design for hypersonics

    Materials design for hypersonics oleh Adam B. Peters, Dajie Zhang, Samuel Chen, Catherine Ott, Corey Oses, Stefano Curtarolo, Ian McCue, Tresa M. Pollock, Suhas Eswarappa Prameela

    Diterbitkan 2024-04-01
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  14. 14
    Machine learned interatomic potentials for ternary carbides trained on the AFLOW database

    Machine learned interatomic potentials for ternary carbides trained on the AFLOW database oleh Josiah Roberts, Biswas Rijal, Simon Divilov, Jon-Paul Maria, William G. Fahrenholtz, Douglas E. Wolfe, Donald W. Brenner, Stefano Curtarolo, Eva Zurek

    Diterbitkan 2024-07-01
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  15. 15
    Dual-phase ceramics based on multi-cation boride and carbide: Investigations at the nanoscale

    Dual-phase ceramics based on multi-cation boride and carbide: Investigations at the nanoscale oleh Steven M. Smith, II, Nicola Gilli, William G. Fahrenholtz, Gregory E. Hilmas, Sandra García-González, Emilio Jiménez-Piqué, Stefano Curtarolo, Laura Silvestroni

    Diterbitkan 2025-01-01
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  16. 16
    Enhancing ductility in bulk metallic glasses by straining during cooling

    Enhancing ductility in bulk metallic glasses by straining during cooling oleh Rodrigo Miguel Ojeda Mota, Ethen Thomas Lund, Sungwoo Sohn, David John Browne, Douglas Clayton Hofmann, Stefano Curtarolo, Axel van de Walle, Jan Schroers

    Diterbitkan 2021-02-01
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  17. 17
    Settling the matter of the role of vibrations in the stability of high-entropy carbides

    Settling the matter of the role of vibrations in the stability of high-entropy carbides oleh Marco Esters, Corey Oses, David Hicks, Michael J. Mehl, Michal Jahnátek, Mohammad Delower Hossain, Jon-Paul Maria, Donald W. Brenner, Cormac Toher, Stefano Curtarolo

    Diterbitkan 2021-09-01
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  18. 18
    Physics in the Machine: Integrating Physical Knowledge in Autonomous Phase-Mapping

    Physics in the Machine: Integrating Physical Knowledge in Autonomous Phase-Mapping oleh A. Gilad Kusne, A. Gilad Kusne, Austin McDannald, Brian DeCost, Corey Oses, Cormac Toher, Stefano Curtarolo, Apurva Mehta, Ichiro Takeuchi, Ichiro Takeuchi

    Diterbitkan 2022-02-01
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  19. 19
    Spectral descriptors for bulk metallic glasses based on the thermodynamics of competing crystalline phases

    Spectral descriptors for bulk metallic glasses based on the thermodynamics of competing crystalline phases oleh Eric Perim, Dongwoo Lee, Yanhui Liu, Cormac Toher, Pan Gong, Yanglin Li, W. Neal Simmons, Ohad Levy, Joost J. Vlassak, Jan Schroers, Stefano Curtarolo

    Diterbitkan 2016-08-01
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  20. 20
    On-the-fly closed-loop materials discovery via Bayesian active learning

    On-the-fly closed-loop materials discovery via Bayesian active learning oleh A. Gilad Kusne, Heshan Yu, Changming Wu, Huairuo Zhang, Jason Hattrick-Simpers, Brian DeCost, Suchismita Sarker, Corey Oses, Cormac Toher, Stefano Curtarolo, Albert V. Davydov, Ritesh Agarwal, Leonid A. Bendersky, Mo Li, Apurva Mehta, Ichiro Takeuchi

    Diterbitkan 2020-11-01
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