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已发表的全部文章列表（下划线代表本人，*代表通讯作者/共同通讯作者，#代表共同第一作者）：

[49] Zhao, J. Y., Wang, J. L., Liu, Y. B., Li, X. R., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Orbital Multiferroicity in Two-Dimensional Triangular Lattice. Phys. Rev. Lett. 136, 206703 (2026).

[48] Chai, S. Y., Wei, W., Li, X. R.*, Dai, Y.*, Huang, B. B., Ma, Y. D.*, Ferroelectric switchable valleytricity in 2D multiferroic semiconductors. Mater. Horiz. 13, 1029-1035 (2026).

[47] Hui, J. X., Ma, Y. D.*, Dai, Y., Huang, B. B., Li, X. R.*, Switchable anomalous valley Hall effect in 2D antiferromagnetic system. Phys. Rev. Mater. 10, 024402 (2026).

[46] Chai, S. Y., Zhao, J. Y., Li, X. R.*, Dai, Y.*, Huang, B. B., Ma, Y. D.*, van Hove Singularity-Induced Non-Equilibrium Anomalous Valley Hall Effect in a Two-Dimensional Lattice. Nano Lett. 25, 4108-4114 (2025).

[45] Liu, Y. B., Feng, Y. Y., Li, X. R., Dai, Y.*, Qian, Z.*, Huang, B. B., Ma, Y. D.*, Ferroelectrovalley induced by lattice breathing in multiferroic single-layer Ce2CO2. Phys. Rev. B 111, 245432 (2025).

[44] Du, W. H., Dou, K. Y., Li, X. R., Dai, Y.*, Wang, Z. Y., Huang, B. B., Ma, Y. D.*, Topological layer Hall effect in two-dimensional type-I multiferroic heterostructure. Nat. Commun. 16, 6141 (2025).

[43] Zhao, J. Y., Feng, Y. Y., Dou, K. Y., Li, X. R., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Light-induced spin slanting in 2D multiferroic magnet. ACS Nano 19, 24005-24012 (2025).

[42] Yang, F., Ji, Y. Q., Li, X. R.*, Dai, Y., Huang, B. B., Ma, Y. D.*, Anomalous valley Hall effect in two-dimensional p-orbital honeycomb lattice. Appl. Phys. Lett. 126, 252404 (2025).

[41] Feng, Y. Y., Zhao, J. Y., Li, X. R., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Electrically switchable ferrovalleytricity in multiferroic heterobilayers. Phys. Rev. B 112, 094109 (2025).

[40] Wang, J. L., Li, X. R.*, Liu, Y. B., Dai, Y., Huang, B. B., Ma, Y. D.*, Ferroelectricity driven interlayer magnetic phase transitions in van der Waals homobilayers. Mater. Horiz. 12, 9661-9668 (2025).

[39] Wang, J. X., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Li, X. R.*, Ferrovalleytricity in 2D multiferroic lattice with self-doped valley carriers. Appl. Phys. Lett. 127, 212406 (2025).

[38] Du, W. H., He, Z. L., Dou, K. Y., Li, X. R., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Chiral magnetic quasiparticles with zero topological charge in 2D lattice. Adv. Funct. Mater. 34, 2400971 (2024).

[37] Yang, J. H., Dou, K. Y., Li, X. R.*, Dai, Y.*, Huang, B. B., Ma, Y. D.*, Strain-driven skyrmion–bimeron switching in topological magnetic monolayer CrSeBr. Mater. Horiz. 11, 5374-5380 (2024).

[36] Lei, C., Cao, S., Gong, Z., Li, X. R., Ma, Y. D., Gao, J., Bi, J., Ahuja, R., Qian, Z.*, Controllable dual-polarization valley physics in the strain-engineered 2D monolayer of VC2N4. J. Mater. Chem. C 12, 2156-2164 (2024).

[35] Sun, Z., Li, X. R.*, Jin, H., Zhao, Z. J., Wei, Y. D.*, Wang, J., Magnetic influence on phonon frequencies in two-dimensional FeOCl: Insights from spin-phonon coupling. Phys. Rev. B 110, 165415 (2024).

[34] Wang, X. D., He, Z. L., Dai, Y.*, Huang, B. B., Li, X. R.*, Ma, Y. D.*, Anomalous dual valley Hall effect in the two-dimensional ferromagnetic honeycomb lattice. Phys. Rev. B 110, 155428 (2024).

[33] Wang, J. X., Feng, Y. Y., Dai, Y.*, Huang, B. B., Ma, Y. D.*, Li, X. R.*, PT symmetry breaking induced anomalous valley Hall effect in 2D antiferromagnetic semiconductor. J. Phys. Chem. Lett. 15, 9968-9973 (2024).

[32] Sun, Z., Li, X. R.*, Zhao, Z. J., Zeng, Y. J., Wei, Y. D.*, Wang, J., Effects of crystal deformation on spin-valley interplay and topological phase transition: a case study on VSi2X4 (X= N or P) monolayers. J. Mater. Chem. C 11, 9815-9824 (2023).

[31] Lei, C., Li, X. R.*, Ma, Y. D., Qian, Z.*, Reversible nonvolatile control of anomalous valley Hall effect in a multiferroic van der Waals heterostructure. Phys. Rev. B 108, 155431 (2023).

[30] Zhao, Z. J., Sun, Z., Li, X. R.*, Yu, Y. J.*, First-principles design on multifunctional magnetic VA2Z4-based Janus structures with controllable magnetic anisotropy energy. Physica B 670, 415369 (2023).

[29] Sun, Z., Li, X. R.*, Li, J. W., Wei, Y. D.*, Guo, H., Wang, J., Intrinsic bitunable magnetism/polarity behavior in 2D Janus Cr2I3Y3 (Y= F, Cl, or Br) systems. npj 2D Mater. Appl. 6, 69 (2022).

[28] Lu, C. H.#, Li, X. R.#, Jin, C., Li, J., Wen, L., Dai, Y., Huang, B. B., Li, B. J., Lou, Z. Z., Nonmetallic surface plasmon resonance coupling with pyroelectric effect for enhanced near-infrared-driven CO2 reduction. Chem. Eng. J. 445, 136739 (2022).

[27] Lu, C. H.#, Li, X. R.#, Wu, Q., Li, J., Wen, L., Dai, Y., Huang, B. B., Li, B. J., Lou, Z. Z., Constructing surface plasmon resonance on Bi2WO6 to boost high-selective CO2 reduction for methane. ACS Nano 15, 3529-3539 (2021).

[26] Zheng, Z. H., Li, X. R., Fu, C., Tian, S., Rational band engineering and structural manipulations inducing high thermoelectric performance in n-type CoSb3 thin films. Nano Energy 81, 105683 (2021).

[25] Chen, Y. X., Shi, X. L., Zheng, Z. H., Two-dimensional WSe2/SnSe pn junctions secure ultrahigh thermoelectric performance in n-type Pb/I Co-doped polycrystalline SnSe. Mater. Today Phys. 16, 100306 (2021).

[24] Jin, H., Su, H. J., Li, X. R.*, Wei, Y. D., Strain-gated nonlinear Hall effect in two-dimensional MoSe2/WSe2 van der Waals heterostructure. Phys. Rev. B 104, 195404 (2021).

[23] Li, X. R.*, Zhang, Z. Y., Zhang, H. B., High throughput study on magnetic ground states with Hubbard U corrections in transition metal dihalide monolayers. Nanoscale Adv. 2, 495-501 (2020).

[22] Li, X. R.*, Sun, Z. N., Li, J. W., Jin, H., Wang, J., Wei, Y. D.*, Noncollinear frustrated antiferromagnetic Mn3P monolayer and its tunability via a spin degree of freedom. J. Mater. Chem. C 8, 11369-11375 (2020).

[21] Li, X. R.*, Zhang, Z. Y., Yao, Y. G., Zhang, H., High throughput screening for two-dimensional topological insulators. 2D Mater. 5, 045023 (2018).

[20] Zhang, Z. Y., Zhang, R. W., Li, X. R., Koepernik, K., Yao, Y. G., Zhang, H., High-throughput screening and automated processing toward novel topological insulators. J. Phys. Chem. Lett. 9, 6224-6231 (2018).

[19] Li, X. R., Dai, Y.*, Niu, C. W., Ma, Y. D., Wei, W., Huang, B. B., MoTe2 is a good match for GeI by preserving quantum spin Hall phase. Nano Res. 10, 2823-2832 (2017).

[18] Li, X. R., Dai, Y.*, Ma, Y. D., Li, M. M., Yu, L., Huang, B. B., Landscape of DNA-like inorganic metal free double helical semiconductors and potential applications in photocatalytic water splitting. J. Mater. Chem. A 5, 8484-8492 (2017).

[17] Ma, X. C., Li, X. R., Li, M. M., Ma, X., Yu, L., Dai, Y.*, Effect of the structure distortion on the high photocatalytic performance of C60/g-C3N4 composite. Appl. Surf. Sci. 414, 124-130 (2017).

[16] Jin, C., Dai, Y.*, Wei, W., Sun, Q. L., Li, X. R., Huang, B. B., Modulation of silicene properties by AsSb with van der Waals interaction. RSC Adv. 7, 5827-5835 (2017).

[15] Li, X. R., Dai, Y.*, Ma, Y. D., Huang, B. B., Exotic quantum spin Hall effect and anisotropic spin splitting in carbon based TMC6 (TM= Mo, W) kagome monolayers. Carbon 109, 788-794 (2016).

[14] Liu, Q., Dai, Y.*, Li, X. R., Ma, Y. D., Ma, X. C., Huang, B. B., Giant spin–orbit coupling topological insulator h-Ga2Bi2 with exotic O-bridge states. Nanoscale 8, 19066-19074 (2016).

[13] Liu, Q., Dai, Y.*, Ma, Y. D., Li, X. R., Li, T. J., Niu, C. W., Huang, B. B., Large gap quantum spin Hall insulators of hexagonal III-bi monolayer. Sci. Rep. 6, 34861 (2016).

[12] Li, X. R., Dai, Y.*, Ma, Y. D., Huang, B. B., Intriguing electronic properties of two-dimensional MoS2/TM2CO2 (TM= Ti, Zr, or Hf) hetero-bilayers: type-II semiconductors with tunable band gaps. Nanotechnology 26, 135703 (2015).

[11] Li, X. R., Dai, Y.*, Ma, Y. D., Huang, B. B., Prediction of large-gap quantum spin hall insulator and Rashba-Dresselhaus effect in two-dimensional g-TlA (A= N, P, As, and Sb) monolayer films. Nano Res. 8, 2954-2962 (2015).

[10] Li, X. R., Dai, Y.*, Li, M. M., Wei, W., Huang, B. B., Stable Si-based pentagonal monolayers: high carrier mobilities and applications in photocatalytic water splitting. J. Mater. Chem. A 3, 24055-24063 (2015).

[9] Jin, H., Dai, Y.*, Ma, Y. D., Li, X. R., Wei, W., Yu, L., Huang, B. B., The electronic and magnetic properties of transition-metal element doped three-dimensional topological Dirac semimetal in Cd3As2. J. Mater. Chem. C 3, 3547-3551 (2015).

[8] Sun, Q. L., Dai, Y.*, Ma, Y. D., Li, X. R., Wei, W., Huang, B. B., Two-dimensional metalloporphyrin monolayers with intriguing electronic and spintronic properties. J. Mater. Chem. C 3, 6901-6907 (2015).

[7] Li, X. R., Dai, Y.*, Ma, Y. D., Han, S. H., Huang, B. B., Graphene/g-C3N4 bilayer: considerable band gap opening and effective band structure engineering. Phys. Chem. Chem. Phys. 16, 4230-4235 (2014).

[6] Li, X. R., Dai, Y.*, Ma, Y. D., Huang, B. B., Electronic and magnetic properties of honeycomb transition metal monolayers: first-principles insights. Phys. Chem. Chem. Phys. 16, 13383-13389 (2014).

[5] Ma, Y. D., Dai, Y.*, Wei, W., Li, X. R., Huang, B. B., Emergence of electric polarity in BiTeX (X= Br and I) monolayers and the giant Rashba spin splitting. Phys. Chem. Chem. Phys. 16, 17603-17609 (2014).

[4] Ma, Y. D., Dai, Y.*, Wei, W., Li, X. R., Huang, B. B., Prediction of two-dimensional materials with half-metallic Dirac cones: Ni2C18H12 and Co2C18H12. Carbon 73, 382-388 (2014).

[3] Wang, W. J., Cheng, H. F., Huang, B. B.*, Li, X. R., Qin, X. Y., Zhang, X. Y., Dai, Y., Ln(IO3)3 (Ln= Ce, Nd, Eu, Gd, Er, Yb) polycrystals as novel photocatalysts for efficient decontamination under ultraviolet light irradiation. Inorg. Chem. 53, 4989-4993 (2014).

[2] Li, X. R., Dai, Y.*, Ma, Y. D., Huang, B. B., Electronic and magnetic properties of one dimensional sandwich polymers: [(Ge5)TM]∞ (TM= Ti, V, Cr, Mn, Fe). J. Mater. Chem. C 1, 4565-4569 (2013).

[1] Ma, Y. D., Dai, Y., Li, X. R., Li, Z. J., Huang, B. B., First-principles study of one-dimensional sandwich wires [(P)5TM]∞ (TM= Ti, V, Cr, Mn, Fe, Co). J. Phys. Condens. Matter 25, 395503 (2013).

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