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Иш: <scp>LAX</scp> phases: A family of novel stable layered materials, informatics‐based discovery

  1. Electrical transport, thermal transport, and elastic properties of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mi>M</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:mi mathvariant="normal">Al</mml:mi><mml:mi mathvariant="normal">C</mml:mi></mml:mrow></mml:math>(<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mi>M</mml:mi><mml:mo>=</mml:mo><mml:mi mathvariant="normal">Ti</mml:mi></mml:mrow></mml:math>, Cr, Nb, and V)

    J. D. Hettinger, S. E. Lofland, Peter Finkel +7

    Мақола20053 иқтибос
    ABI

  2. On the formation mechanisms and properties of MAX phases: A review

    Zhuo Zhang, Xiaoming Duan, Dechang Jia +2

    Шарҳ мақола20213 иқтибос
    ABI

  3. Computational Prediction of Boron-Based MAX Phases and MXene Derivatives

    Nanxi Miao, Junjie Wang, Yutong Gong +7

    Мақола20203 иқтибос
    ABI

  4. High-throughput computational discovery of ternary-layered MAX phases and prediction of their exfoliation for formation of 2D MXenes

    Rasoul Khaledialidusti, Mohammad Khazaei, Somayeh Khazaei +1

    Мақола20213 иқтибос
    ABI

  5. Superlattice MAX Phases with A-Layers Reconstructed into 0D-Clusters, 1D-Chains, and 2D-Lattices

    Mohammad Khazaei, Soungmin Bae, Rasoul Khaledialidusti +12

    Мақола20233 иқтибос
    ABI

  6. First-Principles Determination of the Structure of Magnesium Borohydride

    Xiang‐Feng Zhou, Artem R. Oganov, Guang‐Rui Qian +1

    Мақола20123 иқтибос
    ABI

  7. Pressure-Induced Stabilization and Insulator-Superconductor Transition of BH

    Chaohao Hu, Artem R. Oganov, Qiang Zhu +4

    Мақола20133 иқтибос
    ABI

  8. Evolutionary method for predicting surface reconstructions with variable stoichiometry

    Qiang Zhu, Li Li, Artem R. Oganov +1

    Мақола20133 иқтибос
    ABI

  9. USPEX—Evolutionary crystal structure prediction

    Colin W. Glass, Artem R. Oganov, Nikolaus Hansen

    Мақола20063 иқтибос
    ABI

  10. Machine-learning-assisted materials discovery using failed experiments

    Paul Raccuglia, Katherine C. Elbert, Philip Adler +7

    Мақола20163 иқтибос
    ABI

  11. The thermodynamic scale of inorganic crystalline metastability

    Wenhao Sun, Stephen Dacek, Shyue Ping Ong +6

    Мақола20163 иқтибос
    ABI

  12. Thermodynamic limit for synthesis of metastable inorganic materials

    Muratahan Aykol, Shyam Dwaraknath, Wenhao Sun +1

    Мақола20183 иқтибос
    ABI

  13. The Rise of MXenes

    Yury Gogotsi, Babak Anasori

    Таҳририят мақоласи20193 иқтибос
    ABI

  14. Machine-learning interatomic potentials enable first-principles multiscale modeling of lattice thermal conductivity in graphene/borophene heterostructures

    Bohayra Mortazavi, Evgeny V. Podryabinkin, Stephan Roche +3

    Мақола20203 иқтибос
    ABI

  15. Machine-learning interatomic potentials enable first-principles multiscale modeling of lattice thermal conductivity in graphene/borophene heterostructures

    Mortazavi, Bohayra, Podryabinkin, Evgeny V., Roche, Stephan +3

    Мақола20203 иқтибос
    ABI

  16. Predicting the Electronic and Structural Properties of Two-Dimensional Materials Using Machine Learning

    Ehsan Alibagheri, Bohayra Mortazavi, Timon Rabczuk

    Мақола20213 иқтибос
    ABI

  17. Novel two-dimensional boron oxynitride predicted using the USPEX evolutionary algorithm

    Захар И. Попов, Kseniya A. Tikhomirova, V. A. Demin +4

    Мақола20213 иқтибос
    ABI

  18. Remarkable Optoelectronic Characteristics of Synthesizable Square‐Octagon Haeckelite Structures: Machine Learning Materials Discovery

    Ehsan Alibagheri, Ahmad Ranjbar, Mohammad Khazaei +2

    Мақола20243 иқтибос
    ABI

  19. Beyond metals: theoretical discovery of semiconducting MAX phases and their potential application in thermoelectrics

    Mohammad Khazaei, Iraj Maleki, Namitha Anna Koshi +11

    МақолаMXene and MAX Phase MaterialsPhysical Chemistry Chemical Physics20242 иқтибос
    ABI

  20. A comprehensive survey of M<sub>2</sub>AX phase elastic properties

    M. F. Cover, Oliver Warschkow, Marcela Bilek +1

    Мақола20092 иқтибос
    ABI

  21. The MAX Phases: Unique New Carbide and Nitride Materials

    Michel W. Barsoum, T. El‐Raghy

    Мақола20012 иқтибос
    ABI

  22. Prediction of MAX phases, VN+1SiCN (N=1,2), from first-principles theory

    Chun Fang, Rajeev Ahuja, Olle Eriksson

    Мақола20072 иқтибос
    ABI

  23. Electronic mechanism of hardness enhancement in transition-metal carbonitrides

    Seung-Hoon Jhi, Jisoon Ihm, Steven G. Louie +1

    Мақола19992 иқтибос
    ABI

  24. Trends in electronic structures and structural properties of MAX phases: a first-principles study on M<sub>2</sub>AlC (M = Sc, Ti, Cr, Zr, Nb, Mo, Hf, or Ta), M<sub>2</sub>AlN, and hypothetical M<sub>2</sub>AlB phases

    Mohammad Khazaei, M. Arai, Taizo Sasaki +2

    Мақола20142 иқтибос
    ABI

  25. Microscopic theory of hardness and design of novel superhard crystals

    Yongjun Tian, Bo Xu, Zhisheng Zhao

    Мақола20122 иқтибос
    ABI