First-principles investigations of structural and electronic properties of SnAs/SnAsCl heterostructure
Tài liệu tham khảo
Novoselov, 2004, Electric field effect in atomically thin carbon films, Science, 306, 666, 10.1126/science.1102896
Geim, 2007, The rise of graphene, Nature Mater., 6, 183, 10.1038/nmat1849
Manzeli, 2017, 2D transition metal dichalcogenides, Nat. Rev. Mater., 2, 1, 10.1038/natrevmats.2017.33
Choi, 2017, Recent development of two-dimensional transition metal dichalcogenides and their applications, Mater. Today, 20, 116, 10.1016/j.mattod.2016.10.002
Hu, 2019, Recent progress in 2d group iv–iv monochalcogenides: synthesis, properties and applications, Nanotechnology, 30, 10.1088/1361-6528/ab07d9
Sarkar, 2020, Recent advances in 2d metal monochalcogenides, Adv. Sci., 7, 10.1002/advs.202001655
Gogotsi, 2019
Naguib, 2021, Ten years of progress in the synthesis and development of mxenes, Adv. Mater., 33
Akinwande, 2014, Two-dimensional flexible nanoelectronics, Nature Commun., 5, 5678, 10.1038/ncomms6678
Luo, 2016, Recent advances in 2d materials for photocatalysis, Nanoscale, 8, 6904, 10.1039/C6NR00546B
Hu, 2021, Recent advances of monoelemental 2d materials for photocatalytic applications, J. Hard Mater., 405, 10.1016/j.jhazmat.2020.124179
Xu, 2019, 2020 Roadmap on two-dimensional materials for energy storage and conversion, Chin. Chem. Lett., 30, 2053, 10.1016/j.cclet.2019.10.028
Lu, 2023, Controllable synthesis of 2d materials by electrochemical exfoliation for energy storage and conversion application, Small, 19, 10.1002/smll.202206702
Xiang, 2022, Application of 2d materials in hardware security for internet-of-things: Progress and perspective, Small Struct., 3, 10.1002/sstr.202200060
Chaudhary, 2022, Towards 5th generation ai and iot driven sustainable intelligent sensors based on 2d mxenes and borophene, ECS Sens. Plus, 1, 10.1149/2754-2726/ac5ac6
Xie, 2017, Prediction of new group iv-v-vi monolayer semiconductors based on first principle calculation, Comput. Mater. Sci., 135, 160, 10.1016/j.commatsci.2017.04.005
Wu, 2023, Electronic, optical, piezoelectric properties and photocatalytic water splitting performance of two-dimensional group iv-v compounds, Appl. Surf. Sci., 627, 10.1016/j.apsusc.2023.157317
Barreteau, 2016, High-pressure melt growth and transport properties of sip, sias, gep, and geas 2d layered semiconductors, J. Cryst. Growth, 443, 75, 10.1016/j.jcrysgro.2016.03.019
Wang, 2019, First-principles calculations of aluminium nitride monolayer with chemical functionalization, Appl. Surf. Sci., 481, 1549, 10.1016/j.apsusc.2019.02.015
Liu, 2021, Chemical functionalization of 2d black phosphorus, InfoMat, 3, 231, 10.1002/inf2.12171
Sun, 2016, Transition metal doped arsenene: a first-principles study, Appl. Surf. Sci., 389, 594, 10.1016/j.apsusc.2016.07.091
Luo, 2019, First-principles study on transition-metal dichalcogenide/bse van der waals heterostructures: a promising water-splitting photocatalyst, J. Phys. Chem. C, 123, 22742, 10.1021/acs.jpcc.9b05581
Ren, 2020, A direct z-scheme pts2/arsenene van der waals heterostructure with high photocatalytic water splitting efficiency, Nanoscale, 12, 17281, 10.1039/D0NR02286A
Castellanos-Gomez, 2022, Van der waals heterostructures, Nat. Rev. Methods Primers, 2, 58, 10.1038/s43586-022-00139-1
Liang, 2020, Van der waals heterostructures for high-performance device applications: challenges and opportunities, Adv. Mater., 32, 10.1002/adma.201903800
Luo, 2019, Transition-metal dichalcogenides/mg (oh) 2 van der waals heterostructures as promising water-splitting photocatalysts: a first-principles study, Phys. Chem. Chem. Phys., 21, 1791, 10.1039/C8CP06960C
Giannozzi, 2009, Quantum espresso: a modular and open-source software project for quantum simulations of materials, J. Phys.: Condens. Matter, 21
Giannozzi, 2017, Advanced capabilities for materials modelling with quantum espresso, J. Phys.: Condens. Matter, 29
Perdew, 1996, Generalized gradient approximation made simple, Phys. Rev. Lett., 77, 3865, 10.1103/PhysRevLett.77.3865
Blöchl, 1994, Projector augmented-wave method, Phys. Rev. B, 50, 17953, 10.1103/PhysRevB.50.17953
Heyd, 2003, Hybrid functionals based on a screened coulomb potential, J. Chem. Phys., 118, 8207, 10.1063/1.1564060
Grimme, 2010, A consistent and accurate ab initio parametrization of density functional dispersion correction (dft-d) for the 94 elements h-pu, J. Chem. Phys., 132, 10.1063/1.3382344
Vu, 2020, Effects of different surface functionalization on the electronic properties and contact types of graphene/functionalized-gec van der waals heterostructures, Phys. Chem. Chem. Phys., 22, 7952, 10.1039/C9CP07009E
Khang, 2023, Theoretical prediction of a type-ii bp/sih heterostructure for high-efficiency electronic devices, Dalton Trans., 52, 2080, 10.1039/D2DT03946J
Liang, 2023, Electronic and optical characteristics of silicane/geas van der waals heterostructures: Effects of external electric field and biaxial strain: A first-principles study, Physica E, 153, 10.1016/j.physe.2023.115759
Sheng, 2020, The inse/sih type-ii van der waals heterostructure as a promising water splitting photocatalyst: a first-principles study, Phys. Chem. Chem. Phys., 22, 21436, 10.1039/D0CP03831H
Fu, 2018, One-step synthesis of metal/semiconductor heterostructure nbs2/mos2, Chem. Mater., 30, 4001, 10.1021/acs.chemmater.7b05117
Li, 2020, General synthesis of two-dimensional van der waals heterostructure arrays, Nature, 579, 368, 10.1038/s41586-020-2098-y
Pham, 2022, 2D heterostructures for ubiquitous electronics and optoelectronics: principles, opportunities, and challenges, Chem. Rev., 122, 6514, 10.1021/acs.chemrev.1c00735
