2024年

(1)  X.J. Liu, Z.W. Wang, G.N. Feng, Y.J. Sun, X.T. Zhang, X. Chen, R. Sa*, Q.H. Li, C.H. Sun*, Z.J. Ma*, Coordination Engineering of Heteronuclear Fe-Mo Dual-Atom Catalyst for Promoted Electrocatalytic Nitrogen Fixation: A DFT Study, Chem-Eur J, (2024).

(2) S.C. Li, Z.L. Geng, R.B. Fu*, Z.J. Ma*, X.T. Wu, A potassium lead 2-methylmalonate-iodide nonlinear optical crystal with strong second-harmonic generation response and large birefringence, Scripta Mater, 239 (2024) 115824.

(3)  Y.H. Zhu, Z.L. Geng, H.X. Tang, R.B. Fu*, Z.J. Ma*, X.T. Wu, ASn(C₁₀H₁₂N₂O ₈)Cl•H<sub>2 </s ub>O (<i>A</i> = <i>K</i>, Rb): Nonlinear optical crystals with new distorted Sn(IV)-centered nitrogen-oxygen-chloride polyhedron and wide band gaps, Scripta Mater, 238 (2024) 115728.

(4) J.S. Zhong, B.K. Huang, K.J. Yang, Z.J. Ma*, L.Y. Du, N. Luo, F.J. Tang, C.X. Hou, F.Y. Jiang*, L.T. Kang*, Neutral color and self-healable electrochromic system based on CuI/Cu and I₃<SUP>-</SUP>/I<SUP>-</SUP> conversions, Nano Research, (2024).

2023年

(1)    S. Gao, X. Liu, Z. Wang, Y. Lu, R. Sa, Q. Li, C. Sun*, X. Chen*, Z. Ma*, Spin regulation for efficient electrocatalytic N2 reduction over diatomic Fe-Mo catalyst, J Colloid Interface Sci, 630 (2023) 215-223.

(2) W.-X. Bao, Z.-Q. Zhou, X.-Y. Zhang, R.-B. Fu*, H.-X. Tang, Z.-J. Ma*, X.-T. Wu, Nonlinear optical crystals KPb3(3-C5H4NCOO)2Br5 and KPb3(3-C5H4NCOO)2Cl3Br2 with new Pb-centered nitrogen-halide polyhedrons obtained by the halide anionic substitution, J Alloy Compd, 951 (2023) 169945.

(3) Z.L. Geng, H.X. Tang, R.B. Fu*, Z.J. Ma*, X.T. Wu, A lithium-scandium sulfate with second-harmonic generation response and deep-ultraviolet transparency, Dalton Trans, 52 (2023) 14742-14746.

(4) X. Liu, S. Gao, Z. Wang, Y. Sun, G. Feng, X. Chen, R. Sa, Q. Li, Z. Ma*, Built-in electric field-assisted W-C3/X-C3 van der Waals heterogeneous single-atom catalysts for enhanced electrocatalytic nitrogen reduction, Appl Surf Sci, 619 (2023) 156790.

(5) Z.Y. Liu*, Y.G. Wang, T. Yang, Z.J. Ma*, H.Y. Zhang, H.L. Li, A.L. Xia, Alloying engineering for thermoelectric performance enhancement in p-type skutterudites with synergistic carrier concentration optimization and thermal conductivity reduction, Journal of Advanced Ceramics, 12 (2023) 539-552.
(6) H.-X. Tang, R.-B. Fu*, Z.-J. Ma*, X.-T. Wu, K2(H2O)WO3F2: A new nonlinear optical material with remarkable second-harmonic generation response and enhanced laser damage threshold, J Alloy Compd, 945 (2023) 169288.

(7) Z. Wang, S. Gao, X. Liu, X. Chen, X. Zhang, R. Sa, Q. Li, C. Sun, Z. Ma*, Defective SiC nanotube based single-atom catalysts for electrocatalytic nitrogen fixation with curvature effect, Molecular Catalysis, 549 (2023) 113519.

(8) Q.Q. Zhang, M.Y. Chen, Y.J. Zhang, Y.S. Ye, D.W. Liu, C. Xu, Z.J. Ma, B.Y. Lou, R.S. Yuan, R.J. Sa, Iron/cobalt/nickel regulation for efficient photocatalytic carbon dioxide reduction over phthalocyanine covalent organic frameworks, Nanoscale, 15 (2023) 16030-16038.

(9) G.X. Zhao, W.Y. Yan, Z.R. Wang, Y. Kang, Z.J. Ma, Z.G. Gu, Q.H. Li, J. Zhang, Predict the Polarizability and Order of Magnitude of Second Hyperpolarizability of Molecules by Machine Learning, J Phys Chem A, 127 (2023) 6109-6115.

(10) F.S. Li, Z.Y. Bi, H. Kimura, H.Y. Li, L.Y. Liu, X.B. Xie, X.Y. Zhang, J. Wang, X.Q. Sun, Z.J. Ma, W. Du, C.X. Hou, Energy- and cost-efficient salt-assisted synthesis of nitrogen-doped porous carbon matrix decorated with nickel nanoparticles for superior electromagnetic wave absorption, Advanced Composites and Hybrid Materials, 6 (2023).

 2022年

(1)    R. Sa, B. Luo, Z. Ma*, D. Liu*, The effect of the A-site cation on the stability and physical properties of vacancy-ordered double perovskites A2PtI6 (A = Tl, K, Rb, and Cs), J Solid State Chem 305 (2022) 122714.

(2)    S. Gao, Z. Ma*, C. Xiao, Z. Cui, W. Du, X. Sun, Q. Li, R. Sa, C. Sun*, TM3 (TM = V, Fe, Mo, W) single-cluster catalyst confined on porous BN for electrocatalytic nitrogen reduction, J Mater Sci Technol 108 (2022) 46-53.

(3)    Q.-R. Shui, R.-B. Fu*, Z.-Q. Zhou, Z.-J. Ma*, H.-X. Tang, X.-T. Wu, A Lead Mixed Halide with Three Different Coordinated Anions and Strong Second-Harmonic Generation Response, Chemistry – A European Journal 28 (2022) e202103687.

(4)    S. Gao, Z. Ma*, C. Xiao, W. Du, X. Sun, Q. Li, R. Sa, C. Sun*, High-Throughput computational screening of Single-atom embedded in defective BN nanotube for electrocatalytic nitrogen fixation, Appl Surf Sci, 591 (2022) 153130.

(5)    W.-X. Bao, Z.-Q. Zhou, H.-X. Tang, R.-B. Fu*, Z.-J. Ma*, X.-T. Wu, KPb3(o-C5H4NCOO)2Cl5: a brand-new stable lead chloride with good comprehensive nonlinear optical performance, Inorganic Chemistry Frontiers, 9 (2022) 1830-1835.

(6)    C. Xiao, S. Gao, Z. Cui, X. Liu, Z. Wang, Y. Lu, R. Sa, Q. Li, Z. Ma*, Efficient band structure tuning of single-layer group IV-N semiconductors for visible-light-driven water splitting, Int J Hydrogen Energ, 47 (2022) 28869-28878.

(7)    R. Sa, B. Luo, Z. Ma*, L. Liang, D. Liu*, Revealing the influence of B-site doping on the physical properties of CsPbI3: A DFT investigation, J Solid State Chem, 309 (2022) 122956.

(8)    C. Xiao, Z. Ma*, R. Sa, Z. Cui, S. Gao, W. Du, X. Sun, Q.-h. Li, Adsorption Behavior of Environmental Gas Molecules on Pristine and Defective MoSi2N4: Possible Application as Highly Sensitive and Reusable Gas Sensors, ACS Omega, 7 (2022) 8706-8716.

(9)    Y.-F. Shi#, Z. Ma#, B.-X. Li, X.-T. Wu, H. Lin*, Q.-L. Zhu*, Phase matching achieved by isomorphous substitution in IR nonlinear optical material Ba2SnSSi2O7 with an undiscovered [SnO4S] functional motif, Materials Chemistry Frontiers, 6 (2022) 3054-3061.

(10) Z.-Q. Zhou, R.-B. Fu*, H.-X. Tang, Z.-J. Ma*, X.-T. Wu, An excellent lead oxyiodide with a strong second-harmonic generation response and a large birefringence induced by the oriented arrangement of highly distorted [PbO4I2] polyhedra, Inorganic Chemistry Frontiers, 9 (2022) 4464-4469.

(11) X.Y. Zhang, Z.Q. Zhou, W.X. Bao, H.X. Tang, R.B. Fu*, Z.J. Ma*, X.T. Wu, New lead-iodide formates with a strong second-harmonic generation response and suitable birefringence obtained by the substitution strategy, Chemical Science, 14 (2022) 136-142.

(12) Z.R. Wang, Y.H. Fang, H.X. Lin, G.X. Zhao, W.Y. Yan, Z.J. Ma, Q.H. Li*, J. Zhang*, Bucket Effect to Improve Third-Order Nonlinear Optical Response on Metal-Heteroaromatic Compounds, Chin J Chem, 40 (2022) 2611-2617.

(13) Q.Q. Yao, Y.M. Gan, Z.J. Ma, X.Y. Qian, S.Z. Cai, Y. Zhao*, L.H. Guan, W. Huang, Approaching Superior Potassium Storage of Carbonaceous Anode Through a Combined Strategy of Carbon Hybridization and Sulfur Doping, Energy & Environmental Materials, 5 (2022) 944-953

(14) Y. Yu*, K. Shao, C.H. Niu, L.C. Liu, X.R. Zhu, Z.B. Wang, Z.J. Ma, G.F. Wang, Crystal growth, first-principle calculations, optical properties and laser performances toward a molybdate Er3+:KBaGd(MoO4)3 crystal, J Lumin, 252 (2022) 10.

 2021年

(1)   C. Xiao#, R. Sa#, Z. Ma*, Z. Cui, W. Du, X. Sun, Q. Li, H. Deng, High-throughput screening of transition metal single-atom catalyst anchored on Janus MoSSe basal plane for hydrogen evolution reaction, Int J Hydrogen Energ, DOI https://doi.org/10.1016/j.ijhydene.2020.12.148(2021).

(2)   Z. Cui#, R. Sa#, W. Du, C. Xiao, Q. Li, Z. Ma*, Theoretical screening of group IIIA-VIIA elements doping to promote hydrogen evolution of MoS2 basal plane, Appl Surf Sci, 542 (2021) 148535.

(3)   C. Xiao#, R. Sa#, Z. Cui, S. Gao, W. Du, X. Sun, X. Zhang, Q. Li, Z. Ma*, Enhancing the hydrogen evolution reaction by non-precious transition metal (Non-metal) atom doping in defective MoSi2N4 monolayer, Appl Surf Sci 563 (2021) 150388.

(4)   B.J. Song, Z. Ma*, B. Li, X.T. Wu, H. Lin*, Q.L. Zhu*, Structural Modulation from Cu3PS4 to Cu5Zn0.5P2S8: Single-Site Aliovalent-Substitution-Driven Second-Harmonic-Generation Enhancement, Inorg Chem 60 (2021) 4357-4361.

(5)   Q.R. Shui, H.X. Tang, R.B. Fu*, Y.B. Fang, Z.J. Ma*, X.T. Wu, Cs3Pb2(CH3COO)(2)X-5 (X=I, Br): Halides with Strong Second-Harmonic Generation Response Induced by Acetate Groups, Angew Chem Int Ed 60 (2021) 2116-2119.

(6)   Q. Shui, R. Fu*, H. Tang, Y. Fang, Z. Ma*, X. Wu, Two Lead Halides with Strong SHG Response Obtained by the Isovalent Substitutions of Alkali Metal Cation and Halogen Anion, Inorg Chem 60 (2021) 5290-5296.

(7)   Z.J. Ma*, C.W. Xiao, Z.T. Cui, W. Du, Q.H. Li, R.J. Sa*, C.H. Sun*, Defective Fe3GeTe2 monolayer as a promising electrocatalyst for spontaneous nitrogen reduction reaction, J Mater Chem A 9 (2021) 6945-6954.

(8)   Y.B. Fang, R.B. Fu*, H.X. Tang, Q.R. Shui, Z.J. Ma*, X.T. Wu, Titanium Iodates with a Second-Harmonic-Generation Response, Inorg Chem 60 (2021) 5821-5828.

(9)   Wang, S.; Yang, P.*; Sun, X.; Xing, H.; Hu, J.; Chen, P.*; Cui, Z.; Zhu, W.; Ma, Z*., Synthesis of 3D heterostructure Co-doped Fe2P electrocatalyst for overall seawater electrolysis. Applied Catalysis B: Environmental 2021, 297, 120386.

(1)    |(10) Zhou, Z.-Q.; Shui, Q.-R.; Fu, R.-B.*; Fang, Y.-B.; Ma, Z.-J.*; Wu, X.-T., KCs2[Pb2Br5(HCOO)2]: A Polar 3D Lead-Bromide Framework Exhibiting Strong Second-Harmonic Generation Response. Chemistry – A European Journal 2021,

(10)  Zha, W.; Liu, D.; Ma, Z.; Wang, Y.; Wei, Y.; Ma, X.; Wang, L.; Zhang, Q.; Lou, B.; Yuan, R.*; Fu, X.; Sa, R.*, Efficient electrochemical CO2 reduction on C2N monolayer supported transition metals trimer catalysts: A DFT study. Appl Surf Sci 2021, 564, 150331.

(11)  Q.-R. Shui, R.-B. Fu*, Z.-Q. Zhou, Z.-J. Ma*, H.-X. Tang, X.-T. Wu, A Lead Mixed Halide with Three Different Coordinated Anions and Strong Second-Harmonic Generation Response, Chemistry – A European Journal n/a.https://doi.org/10.1002/chem.202103687

(12)  H.-X. Tang, R.-B. Fu*, Z.-J. Ma*, X.-T. Wu, A Potassium Tungsten Oxyfluoride with Strong Second-Harmonic Generation Response Derived from Anion-Ordered Functional Motif, Inorg Chem 60 (2021) 17364-17370.

(13)  Y. Xiao, S.-H. Zhou, R. Yu, Y. Shen, Z. Ma, H. Lin*, Y. Liu*, Rb2CuSb7S12: Quaternary Antimony-Rich Semiconductor Featuring a Three-Dimensional Open Framework and Exhibiting an Intriguing Photocurrent Response, Inorg Chem 60 (2021) 9263-9267.

(14)  H.-X. Tang, Q.-R. Shui, R.-B. Fu*, Z.-Q. Zhou, W.-X. Bao, Z.-J. Ma*, X.-T. Wu, Zn(NH3)CO3: a “three-in-one” UV nonlinear optical crystal built by a polar molecule bonding strategy, J Mater Chem C 9 (2021) 16477-16484.

(15)  M.-Y. Ran#, Z. Ma#, X.-T. Wu, H. Lin*, Q.-L. Zhu*, Ba2Ge2Te5: a ternary NLO-active telluride with unusual one-dimensional helical chains and giant second harmonic-generation tensors, Inorganic Chemistry Frontiers 8 (2021) 4838-4845.

(16)  M.-M. Chen#, Z. Ma#, B.-X. Li, W.-B. Wei, X.-T. Wu, H. Lin*, Q.-L. Zhu*, M2As2Q5 (M = Ba, Pb; Q = S, Se): a source of infrared nonlinear optical materials with excellent overall performance activated by multiple discrete arsenate anions, J Mater Chem C 9 (2021) 1156-1163.

 2020年

(1)     H.-X. Tang, C. Zhuo, Y.-X. Zhang, Q.-R. Shui, R.-B. Fu,* Z.-J. Ma,* X.-T. Wu, AxCe9(IO3)36 (A = K, La): the effects of a change in the intermediate valence on the second-harmonic generation response, Dalton Trans, 49 (2020) 3672-3675.

(2)     C. He, G. Liu, H. Zhao, K. Zhao, Z. Ma,* X. An,* Inorganic photovoltaic cells based on BiFeO3: spontaneous polarization, lattice matching, light polarization and their relationship with photovoltaic performance, Phys Chem Chem Phys, 22 (2020) 8658-8666.

(3)     Z. Ma,* Z. Cui, C. Xiao, W. Dai, Y. Lv, Q. Li, R. Sa,* Theoretical screening of efficient single-atom catalysts for nitrogen fixation based on a defective BN monolayer, Nanoscale, 12 (2020) 1541-1550.

(4)     X. Chen,* H. Wang, R. Meng, B. Xia, Z. Ma,* Cadmium Hydroxide: A Missing Non-Noble Metal Hydroxide Electrocatalyst for the Oxygen Evolution Reaction, ACS Applied Energy Materials, 3 (2020) 1305-1310.

(5)     M.-Y. Li, ^# Z. Ma, ^# B. Li, X.-T. Wu, H. Lin,* Q.-L. Zhu,* HgCuPS4: An Exceptional Infrared Nonlinear Optical Material with Defect Diamond-like Structure, Chem Mater, (2020). DOI：10.1021/acs.chemmater.0c01258

(6)     M. Y. Ran, Z. Ma, H. Chen, B. Li, X. T. Wu, H. Lin,* Q. L. Zhu,* Partial isovalent anion substitution to access remarkable second-harmonic generation response: a generic and effective strategy for design of IR NLO materials, Chem Mater (2020). DOI:10.1021/acs.chemmater.0c02011

(7)     Cui, Z.; Xiao, C.; Lv, Y.; Li, Q.; Sa, R.; Ma, Z.*, Adsorption behavior of CO, CO2, H2, H2O, NO, and O2 on pristine and defective 2D monolayer Ferromagnetic Fe3GeTe2. Appl Surf Sci 2020, 146894.

(8)     Ma, Z.; Cui, Z.; Lv, Y.; Sa, R.*; Wu, K*.; Li, Q., Three-in-One: Opened Charge-transfer channel, positively shifted oxidation potential, and enhanced visible light response of g-C3N4 photocatalyst through K and S Co-doping. Int J Hydrogen Energ 2020, 45 (7), 4534-4544.

(9)     Yang, Y.; Zhou, X.; Pan, F.; Ma, Z.; Sa, R.; Zheng, J.*; Wang, Q.*, Effect of rare-earth doping on adsorption of carbon atom on ferrum surface and in ferrum subsurface: A first-principles study. J Rare Earth 2020.

(10)  Cui, Z.; Du, W.; Xiao, C.; Li, Q.; Sa, R.*; Sun, C.*; Ma, Z.*, Enhancing hydrogen evolution of MoS2 basal planes by combining single-boron catalyst and compressive strain. Frontiers of Physics 2020, 15 (6), 63502.

(11)  Sa, R. J.*; Zha, W. Y.; Ma, Z. J.; Yuan, R. S.; Liu, D. W.*, Stable lead-free perovskite solar cells: A first -principles investigation. Spectrochim Acta A 2020, 239.

(12)  Sa, R. J.*; Ma, Z. J.; Wang, J.; Liu, D. W.*, The effect of organic cation doping on the stability and optoelectronic properties of alpha-CsPbI3. J Solid State Chem 2020, 290.

(13)  Liu, D. W.; Sa, R. J.*; Ma, Z. J.*, The effect of divalent europium doping on stability and electronic properties of CH3NH3PbI3: a theoretical investigation. Applied Physics Express 2020, 13 (10).

 2019年

(1)     Y.-X. Zhang, B.-X. Li, H. Lin,* Z. Ma,* X.-T. Wu, Q.-L. Zhu,* Impressive second harmonic generation response in a novel phase-matchable NLO-active MOF derived from achiral precursors, J Mater Chem C, 7 (2019) 6217-6221.

(2)     M.-Y. Li, y.x. zhang, H. Lin,* Z. Ma,* X. Wu, Q.-L. Zhu,* Combined experimental and theoretical investigations of Ba3GaS4I: interesting structure transformation originated from the halogen substitution, Dalton Trans, 48 (2019) 17588.

(3)     Y.-F. Shi, X.-F. Li, Y.-X. Zhang, H. Lin,* Z. Ma,* L.-M. Wu,* X.-T. Wu, Q.-L. Zhu,* [(Ba19Cl4)(Ga6Si12O42S8)]: a Two-Dimensional Wide-Band-Gap Layered Oxysulfide with Mixed-Anion Chemical Bonding and Photocurrent Response, Inorg Chem, 58 (2019) 6588-6592.

(4)     H.-X. Tang, Y.-X. Zhang, C. Zhuo, R.-B. Fu,* H. Lin, Z.-J. Ma,* X.-T. Wu, A Niobium Oxyiodate Sulfate with a Strong Second-Harmonic-Generation Response Built by Rational Multi-Component Design, Angewandte Chemie International Edition 58 (2019) 3824-3828. 

(5)     H. Lin, Y.-Y. Li, M.-Y. Li, Z. Ma,* L.-M. Wu,* X.-T. Wu, Q.-L. Zhu,* Centric-to-acentric structure transformation induced by a stereochemically active lone pair: a new insight for design of IR nonlinear optical materials, J Mater Chem C 7 (2019) 4638-4643.

(6)     Wan, Q.; Wei, F.; Ma, Z.*; Anpo, M.; Lin, S.*, Novel Porous Boron Nitride Nanosheet with Carbon Doping: Potential Metal-Free Photocatalyst for Visible-Light-Driven Overall Water Splitting. Advanced Theory and Simulations 2019. DOI:10.1002/adts.201800174. 

(7)     Wang, X^#.; Ma, Z^#.; Chai, L.; Xu, L.; Zhu, Z.; Hu, Y.; Qian, J.; Huang, S., MOF derived N-doped carbon coated CoP particle/carbon nanotube composite for efficient oxygen evolution reaction. Carbon 2019, 141, 643-651. 

 2018年

(1)  Ma, Z.; Wu,K*. Synergistic effect of doping and compositing on photocatalytic efficiency: a case study of La₂Ti₂O_7,  ACS Applied Materials & Interfaces, 2018. 10 (45), 39327-39335. 

(2)  Li, M.-Y.; Li, B.-X.; Lin, H.*; Shi, Y.-F.; Ma, Z*.; Wu, L.-M.*; Wu, X.-T.; Zhu, Q.-L.*, Ternary Mixed-Metal Cd4GeS6: Remarkable Nonlinear-Optical Properties Based on a Tetrahedral-Stacking Framework. Inorg Chem 2018, 57 (15), 8730-8734. 

 2017年

(1)  Ma Z, Hu J, Sa R, Li Q, Zhang Y, Wu K*, Screening novel candidates for mid-IR nonlinear optical materials from I3–V–VI4 compounds, J Mater Chem C, 2017，5: 1963-1972. 

(2)  Z Ma, S Lin, R Sa, Q Li, K Wu*, A comprehensive understanding of water photooxidation on Ag3PO 4 surfaces, RSC Advances, 2017, 7 (39), 23994-24003 

(3)  Y Peng^#, Z Ma^#, J Hu, K Wu*, A first-principles study of anionic (S) and cationic (V/Nb) doped Sr 2 Ta 2 O 7 for visible light photocatalysis, RSC Advances, 2017, 7 (65), 40922-40928 

(4)   Q Li, Z Ma, R Sa, H Adidharma, K Gasem, AT Russell, M Fan, W Kechen*, Computation-Predicted, Stable, and Inexpensive Single-atom Nanocatalyst Pt@ Mo2C–an Important Advanced Material for H2 Production, Journal of Materials Chemistry A, 2017

(5)  J Li, J Shen, Z Ma, K Wu*, Thickness-controlled electronic structure and thermoelectric performance of ultrathin SnS2 nanosheets, Scientific Reports, 2017, 7 (1), 8914

(6)  Hu J, Ma Z, Sa R, Zhang Y, Wu K*, A promising lead-free fluoride carbonate SHG material designed from a theoretical perspective, Dalton Trans, 2017, 46: 2635-2642. 

(7)  Li J, Ma Z, Wu K*, Thermoelectric enhancement in sliver tantalate via strain-induced band modification and chemical bond softening, RSC Advances, 2017, 7: 8460-8466. 

2016 before

(1) Ma ZJ, Wu KC*, Sun BZ, He C, Band engineering of AgSb1-xBixO3 for photocatalytic water oxidation under visible light, J Mater Chem A, 2015, 3: 8466-8474. 

(2) Ma Z, Sa R, Li Q, Wu K*, Interfacial electronic structure and charge transfer of hybrid graphene quantum dot and graphitic carbon nitride nanocomposites: insights into high efficiency for photocatalytic solar water splitting, Phys Chem Chem Phys, 2016, 18: 1050-1058. 

(3) Ma Z, Wu K*, Sa R, Li Q, He C, Yi Z, Mechanism of enhanced photocatalytic activities on N-doped La2Ti2O7: An insight from density-functional calculations, Int J Hydrogen Energ, 2015, 40: 980-989. 

(4) Ma, Z.; Yi, Z.; Sun, J.; Wu, K., Electronic and Photocatalytic Properties of Ag3PC4VI (C = O, S, Se): A Systemic Hybrid DFT Study. J Phys Chem C 2012, 116 (47), 25074-25080.

(5) Ma, Z.; Wu, K.; Sa, R.; Li, Q.; Zhang, Y., Ab initio study of elasticity, piezoelectricity, and nonlinear optical performance in monoclinic NaAsSe2. J Alloy Compd 2013, 568, 16-20.

(6) Zhang H, Ma Z, Duan J, Liu H, Liu G, Wang T, Chang K, Li M, Shi L, Meng X, Wu K, Ye J*, Active Sites Implanted Carbon Cages in Core–Shell Architecture: Highly Active and Durable Electrocatalyst for Hydrogen Evolution Reaction, ACS Nano, 2016, 10: 684-694. 

(7).Zhang H, Ma Z, Liu G, Shi L, Tang J, Pang H, , Wu K, Takei T, Zhang J, Yamauchi Y, Ye J*, Highly active nonprecious metal hydrogen evolution electrocatalyst: ultrafine molybdenum carbide nanoparticles embedded into a 3D nitrogen-implanted carbon matrix, NPG Asia Mater, 2016, 8: e293.

(8) Long X, Ma Z, Yu H, Gao X, Pan X, Chen X, Yang S, Yi Z*, Porous FeNi oxide nanosheets as advanced electrochemical catalysts for sustained water oxidation, J Mater Chem A, 2016. 

(9). Li J, Ma Z, He C, Li Q, Wu K*, An effective strategy to achieve deeper coherent light for LiB3O5, J Mater Chem C, 2016, 4: 1926-1934. 

(10).  Pan M-y, Ma Z-j, Liu X-c, Xia S-q*, Tao X-t, Wu K-c*, Ba(4)AgGa(5)Pn(8) (Pn = P, As): new pnictide-based compounds with nonlinear optical potential, J Mater Chem C, 2015, 3: 9695-9700.

(11). Li Q, Qiao L, Chen R, Ma Z, Si R, Yao Y*, Wu K*, Carbon monoxide oxidation catalysed by defective palladium chloride: DFT calculations, EXAFS, and in situ DRIRS measurements, Phys Chem Chem Phys, 2016, 18: 2784-2791.

(12). Hu J, Ma Z, Li J, He C, Li Q, Wu K*, Strain engineering of nonlinear boron phosphate for phase matching in the ultraviolet region: a first-principles study, J Phys D Appl Phys, 2016, 49: 85103-85103. 

(13).  Sun B-Z, Ma Z, He C, Wu K*, Anisotropic thermoelectric properties of layered compounds in SnX2 (X = S, Se): a promising thermoelectric material, Phys Chem Chem Phys, 2015, 17: 29844-29853.

(14).   Sun B-Z, Ma Z, He C, Wu K*, Enhanced thermoelectric performance of layered SnS crystals: the synergetic effect of temperature and carrier concentration, Rsc Advances, 2015, 5: 56382-56390. 

(15).  Ren J, Ma Z, He C, Sa R, Li Q, Wu K*, Structure, elastic and piezoelectric properties of A(3)BO(7) (A = Ga, Al; B = P, As) compounds: A DFT study, Comp Mater Sci, 2015, 106: 1-4. 

(16).  Li Q, Wei Y, Sa R, Ma Z, Wu K*, A novel Pd3O9@alpha-Al2O3 catalyst under a hydroxylated effect: high activity in the CO oxidation reaction, Phys Chem Chem Phys, 2015, 17: 32140-32148. 

(17).  He C, Ma Z-J, Sun B-Z, Sa R-J, Wu K*, The electronic, optical and ferroelectric properties of BiFeO3 during polarization reversal: A first principle study, J Alloy Compd, 2015, 623: 393-400.

(18).  He C, Ma Z, Sun B-Z, Li Q, Wu K*, Ab-initio study on the electronic, optical and ferroelectric properties of LiOsO3, Comp Mater Sci, 2015, 105: 11-17.