محمد خزائی

مقالات علمی چاپ شده در مجلات

1. "Superconductivity in Janus M ₂ X MXenes (M = W, Mo, Nb, and X = C, N) functionalized with hydrogen and bromine"
   Abolfazl Zarenejad, Mohammad Sandoghchi, Mohammad Khazaei, Mohammad Reza Mohammadi Zadeh
   PHYSICAL CHEMISTRY CHEMICAL PHYSICS, Vol. 28, No 27, pp.17034-17042, 2026
2. "A physics-informed machine learning framework for unified prediction of superconducting transition temperatures"
   Ehsan Alibagheri, محمد صندوقچی, [] [], Mohammad Khazaei, Seyed Mehdi Vaez Allaei
   Materials Today Physics, Vol. 60, No 1, 2026
3. "Data-driven discovery of novel synthesizable MAX phase materials"
   Ehsan Alibagheri, Mohammad Khazaei, Mehdi Estili, S.Ali Moslehi, Kaoru Ohno, Seyed Mehdi Vaez Allaei
   Applied Materials Today, Vol. 46, No 46, 2025
4. "Synthesizable Two-Dimensional Haeckelites with Auxetic Behavior and Multifunctional Properties: A Computational Study Integrating Machine Learning Interatomic Potentials"
   Ehsan Alibagheri, Mohammad Khazaei, Bassam Rabihavi, Ahmad Ranjbar, Thomas D. Kuhne, Seyed Mehdi Vaez Allaei
   ACS Materials Letters, Vol. 7, No 7, pp.3527-3536, 2025
5. "Diverse surface reconstructions in MAX phases"
   Mohammad Khazaei, Mohammad Bagheri, Ahmad Ranjbar, Soungmin Bae, Rasoul Khaledialidusti, Yasuhide Mochizuki, Thomas D. Kuhne, Ken-ichi Shudo, Hannes Raebiger, Hannu-Pekka Komsa, Hideo Hosono
   Nanoscale, Vol. 17, 2025
6. "Prediction of Superconductivity in Haeckelite Compounds using first-principles Calculations"
   Kaenat Hamidi, Mohammad Keivanloo, Mohammad Sandoghchi, Mohammad Reza Mohammadi Zadeh, Hannes Raebiger, Kenta Hongo, Ryo Maezono, Kaoru Ohno, Mohammad Khazaei
   IScience, Vol. 28, No 8, 2025
7. "Synthesis and characterization of Ti₃C₂T ₓ MXene with preserved MAX phase structure via optimized delamination"
   Asma Eskandarli, Mohammad Khazaei, Mohammad Reza Mohammadi Zadeh
   Materials and Solidification, Vol. 1, No 1, 2025
8. "Harnessing Z-scheme charge transfer in ultrathin C N /TiO2@Ti C Cl MXene nanosheets for sustainable water purification, hydrogen evolution, and biocompatibility"
   Mojtaba Rostami, Ghodsi Mohammadi Ziarani, Ali Reza Badiei, Jahan Bakhsh Ghasemi, Mohammad Khazaei, Milad Jourshabani, Byeong Lee
   Journal of Science-Advanced Materials and Devices, Vol. 10, No 1, 2025
9. "LAX phases: A family of novel stable layered materials, informatics‐based discovery"
   Ehsan Alibagheri, Mohammad Khazaei, Mehdi Estili, Alireza Seyfi, Hiroshi Mizoguchi, Kaoru Ohno, Hideo Hosono, Seyed Mehdi Vaez Allaei
   InfoMat, Vol. 7, No 7, 2025
10. "Theoretical Insights into Two-Dimensional Semiconducting Transition Metal Borides: MB₉ (M = Ag and Tm)"
    Shouhao Wang, Yue Wang, Jiahao Yu, Mohammad Khazaei, Jun Yu, Junjie Wang
    Journal of Physical Chemistry C, Vol. 129, No 5, pp.2747-2756, 2025
11. "Superconductivity in o-MAX phases"
    Mohammad Keivanloo, محمد صندوقچی, Mohammad Reza Mohammadi Zadeh, Mitsuaki Kawamura, Hannes Raebiger, Kenta Hongo, Ryo Maezono, Mohammad Khazaei
    Nanoscale, Vol. 17, No 9, 2025
12. "Computational Design of the Electronic Response for Volatile Organic Compounds Interacting with Doped Graphene Substrates"
    Li Chen, David Bodesheim, Ahmad Ranjbar, Arezoo Dianat, Robert Biele, Rafael Gutierrez, Mohammad Khazaei, Gianaurelio Cuniberti
    Nanomaterials, Vol. 14, No 22, 2024
13. "Valley-Polarized Topological Phases with In-Plane Magnetization"
    Ranjan Kumar Barik, Subhendu Mishra, Mohammad Khazaei, Shiyao Wang, Yunye Liang, Yann Sun, Ahmad Ranjbar, Teck Leong Tan, Junjie Wang, Seiji Yunoki, Kaoru Ohno, Yoshiyuki Kawazoe, Abhishek K. Singh
    NANO LETTERS, Vol. 24, No 42, pp.13213-13218, 2024
14. "Study on superconductivity in $$\hbox {Nb}_{{2}}$$SC and $$\hbox {Nb}_{2}$$AsC MAX phases at various pressures"
    Mohammad Keivanloo, Mohammad Sandoghchi, Mohammad Reza Mohammadi Zadeh, Mohammad Khazaei
    Scientific Reports, Vol. 14, No 1, 2024
15. "Beyond metals: theoretical discovery of semiconducting MAX phases and their potential application in thermoelectrics"
    Mohammad Khazaei, Iraj Maleki, Namitha Anna Koshi, Ahmad Ranjbar, Nanxi Miao, Junjie Wang, Rasoul Khaledialidusti, Thomas D. Kuhne, Seung-Cheol Lee, Satadeep Bhattacharjee, Hamid Hosano, Seyed Mehdi Vaez Allaei, Keivan Esfarjani, Kaoru Ohno
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, Vol. 26, No 27, pp.18907-18917, 2024
16. "Remarkable Optoelectronic Characteristics of Synthesizable Square‐Octagon Haeckelite Structures: Machine Learning Materials Discovery"
    Ehsan Alibagheri, Mohammad Khazaei, Ahmad Ranjbar, Thomas D. Kuhne, Seyed Mehdi Vaez Allaei
    ADVANCED FUNCTIONAL MATERIALS, Vol. 34, No 27, 2024
17. "Prediction of Two-dimensional B₉ as High-performance Anode Material for Li/Na/K-ion Batteries"
    Yi Song, Yaxin Di, Shiyao Wang, Mohammad Khazaei, Junjie Wang
    Journal of Physical Chemistry C, Vol. 127, No 48, 2023
18. "Electronic and optical properties of C60/Ti2CT2 and C60/Ti3C2T2 (T F, OH, or O) Heterostructures"
    Zahra Hajiahmadi, Mohammad Khazaei, Ahmad Ranjbar, Alireza Mostafaei, Sergii Chertopalov, Thomas D. Kuhne, Gianaurelio Cuniberti, Hamid Hosano, Hannes Raebiger, Kaoru Ohno
    COMPUTATIONAL MATERIALS SCIENCE, Vol. 228, 2023
19. "Superlattice MAX Phases with A-Layers Reconstructed into 0D-Clusters, 1D-Chains, and 2D-Lattices"
    Mohammad Khazaei, Soungmin Bae, Rasoul Khaledialidusti, Hannu-Pekka Komsa, Somayeh Khazaei, Mohammad Bagheri, Vei Wang, Yasuhide Mochizuki, Mitsuaki Kawamura, Gianaurelio Cuniberti, Seyed Mehdi Vaez Allaei, Kaoru Ohno, Hideo Hosono, Hannes Raebiger
    Journal of Physical Chemistry C, Vol. 127, No 30, 2023
20. "High-throughput study and machine learning on MAX and MAB phases: new materials and fingerprints of superior lattice thermal conductivities"
    Shaohan Li, Zening Yang, Rasoul Khaledialidusti, Shuai Lin, Jin Yu, Mohammad Khazaei, Jing Zhang, Litao Sun, Xin Li, Weiwei Sun
    ACTA MATERIALIA, Vol. 254, 2023
21. "Phase diagram exploration of Tc–Al–B: from bulk Tc2AlB2 to two-dimensional Tc2B2"
    Heng Zhang, Junjie Wang, Mohammad Khazaei, Frederic Guegan, Gilles Frapper
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, Vol. 23, No 38, pp.22086-22095, 2022
22. "Electronic Structures of Group III–V Element Haeckelite Compounds: A Novel Family of Semiconductors, Dirac Semimetals, and Topological Insulators"
    Mohammad Khazaei, Ahmad Ranjbar, Yunye Liang, Yoon-Gu Kang, Rasoul Khaledialidusti, Soungmin Bae, Hannes Raebiger, Vei Wang, Myung Joon Han, Hiroshi Mizoguchi, Mohammad S. Bahramy, Thomas. D. Kuhne, Rodion V. Belosludov, Kaoru Ohno, Hideo Ohno
    ADVANCED FUNCTIONAL MATERIALS, Vol. -, 2022
23. "Strain Engineering to Release Trapped Hole Carriers in p-Type Haeckelite GaN"
    Soungmin Bae, Yoon-Gu Kang, Mohammad Khazaei, Kodai Ichihashi, Varghese Swamy, Myung Joon Han, Kee Joo Chang, Ken-ichi Shudo, Hannes Raebiger
    ACS Applied Electronic Materials, Vol. 3, No 12, pp.5257-5264, 2021
24. "Facile Synthesis of Ti₂AC (A = Zn, Al, In, and Ga) MAX Phases by Hydrogen Incorporation into Crystallographic Voids"
    Yangfan -Lu, Mohammad Khazaei, Xinmeng -Hu, Rasoul Khaledialidusti, Masato Sasase, Jiazhen Wu-, Hideo Hosono
    Journal of Physical Chemistry Letters, Vol. 12, No 46, pp.11245-11251, 2021
25. "Hypercoordinate two-dimensional transition-metal borides for spintronics and catalyst applications"
    Shiyao Wang, Mohammad Khazaei, Junjie Wang, Hideo Hosono
    Journal of Materials Chemistry C, Vol. 9, No 9212, 2021
26. "MXene Phase with C ₃ Structure Unit: A Family of 2D Electrides"
    Soungmin Bae, William Espinosa-Garcia, Yoon-Gu Kang, Noriyuki Egawa, Juho Lee, Kazuaki Kuwahata, Mohammad Khazaei, Kaoru Ohno, Yong-Hoon Kim, Myung Joon Han, Hideo Hosono, Gustavo M. Dalpian, Hannes Raebiger
    ADVANCED FUNCTIONAL MATERIALS, Vol. 31, No 24, 2021
27. "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, Kaoru Ohno
    Nanoscale, Vol. 13, No 15, pp.7294-7307, 2021
28. "Exploring structural, electronic, and mechanical properties of 2D hexagonal MBenes"
    Rasoul Khaledialidusti, Mohammad Khazaei, Vei Wang, Nanxi Miao, Chen -Shi, Jianfeng Wang, Junjie Wang
    JOURNAL OF PHYSICS-CONDENSED MATTER, Vol. 33, No 15, 2021

مقالات علمی ارائه شده در همایش‌ها

1. "ساخت و مشخصه یابی صفحات دوبعدی Ti2Cبه روش لایهبرداری با اسید HF"
   اسماء اسکندرلی، محمد خزائی، محمدرضا محمدی زاده
   شانزدهمین کنفرانس ماده چگال انجمن فیزیک ایران، 1401
2. "بررسی خواص الکترونی و ساختاری فازهای مکس و سیستمهای دوبعدی آنها (مکسین)"
   محمد خزائی
   شانزدهمین کنفرانس فیزیک ماده چگال، 1401