Z. Z. Feng(冯真真), T. T. Jia, J. H. Zhang, Y. X. Wang, Y. S. Zhang*, Dual effects of lone-pair electrons and rattling atoms in CuBiS2 on its ultralow thermal conductivity. Phys. Rev. B, 96, 235205(2017). (link)

Hua Hao(郝华), XiaoHong Zheng, Ting Jia and Zhi Zeng*, Magnetic crossover realized by electrical methods，Journal of Physics: Conf. Series 827, 012003 (2017).(link) 

Yong Yang(杨勇)*, Unexpected robustness of the band gaps of TiO₂ under high Pressures, J. Phys. Commun. 1, 055014(2017). (link)

Ya-Min Quan(全亚民), Wei-Cheng Bao,Wei-Hua Wang and Da-Yong Liu, Phase diagrams of the Kane-Mele-Hubbard model in the presence of an external magnetic field, Journal of Physics: Conf. Series 827, 012009 (2017).(Link)

Hongying Mei（梅红樱）, Chao Zhang*, Chao Wang, Changneng Liang, Jie Zhang, Lan Ding, Jin Zhang, ang Wen Xu*, Detection of phase separation and nano-droplet states in La_0.33Pr_0.34Ca_0.33MnO₃ nanowires via near-infrared reflection experiments. Opt. Mater. Express 7(11), 3809-3814 (2017). (Link)

李婷婷, 黄孙超, 张小丽, 曾雉*, 无序合金高通量计算平台HCPRA 的搭建及其应用，科学通报62, 3894–3901, (2017). (link)

T.Jia(贾婷), Z. Zeng*, H. Q. Lin, Y. Duan and P. Ohodnicki, First-principles study on the electronic, optical and thermodynamic properties of ABO₃ (A = La,Sr, B = Fe,Co) perovskites, RSC Advances 7, 38798(2017).(Link)

T.Jia(贾婷), Z. Zeng* and H. Q. Lin, The collinear ↑↑↓↓ magnetism driven ferroelectricity in double-perovskite multiferroics, Journal of Physics: Conference Series 827, 012005(2017).(Link)

T.Jia(贾婷), Z. Zeng* and H. Q. Lin, Pressure-induced structural, magnetic and transport transitions in Sr₂FeO₃ from first-principles, AIP Advances 7, 055703 (2017). (Link)

Miaomiao Han(韩苗苗), Xiaoli Zhang and Zhi Zeng*, An investigation of Na-related defects in Cu2ZnSnSe4, Phys. Chem. Chem. Phys. 19, 17799 (2017). (Link)

Miaomiao Han(韩苗苗), Zhi Zeng*, Thomas Frauenheim and Peter Deák*, Defect physics in intermediate band semiconductors: insights from an optimized hybrid functional, Phys. Rev. B 96, 165204 (2017).(Link)

Hua Hao(郝华), Ting Jia, Xiaohong Zheng, Lingling Song and Zhi Zeng*, Realizing bias-induced spin transition with high-spin Mn_II complexes at room temperature, J. Mater. Chem. C 5, 11598-11604 (2017). (Link). 

Chuanguo Zhang(张传国), Xianlong Wang, Jie Zhang, Kaishuai Yang, Ya Cheng, Zhi Zeng*, Xianming Zhou, Haiqing Lin, Schottky defects induced effects on the behaviors of high velocity shock compression of MgO, RSC Advances 7, 45304-45310(2017). (Link)

G.Y. Pan (潘古月), Y.S. Zhang, Y.G. Li, C.G. Zhang, Z. Zhao, Z. Zeng*, Orientation-dependent behaviors of H dissolution and diffusion near W surfaces: A first-principles study, International Journal of Modern Physics C 28, 1750090 (2017).  (Link).

X. L. Yu (虞祥龙), D.Y. Liu, Y.M. Quan, J. S. Wu, H.Q. Lin, K. Chang,  and L.J. Zou*, Electronic correlation effects and orbital density wave in the layered compound 1T-TaS2, Phys. Rev. B 96, 125138 (2017). (Link) 

 Z. Zhao (赵哲), Y.G. Li*, C.G. Zhang, G.Y. Pan, P.F. Tang and Z. Zeng*, Effects of grain size on the behavior of hydrogen/helium retention in tungsten: A cluster dynamics modeling, Nucl. Fusion 57, 086020 (2017). (Link)

 P. Jiang(姜朋), X.X. Tao, H. Hao, L.L. Song, X.H. Zheng*, L. Zhang* and Z. Zeng, Tuning a zigzag SiC nanoribbon as a thermal spin current generator, 2D Materials 4, 035001(2017).(Link)

G.Y. Pan (潘古月), Y.G. Li*, Y.S. Zhang, C.G. Zhang, Z. Zhao, Z. Zeng*,  First-principles investigation of orientations influenced He dissolution and diffusion behaviors in W surfaces. RSC Advances 7, 25789 (2017). (Link)

T.T. Jia(贾甜甜), G. Chen and Y.S. Zhang*, Lattice thermal conductivity evaluated using elastic properties, Phys. Rev. B95, 155206 (2017). (Link)

P. Jiang(姜朋), X.X. Tao, H. Hao, L.L. Song, *X.H. Zheng, and Z. Zeng, Thermal spin current in  zigzag silicene nanoribbons with sp2-sp3 edges, RSC Advances 7, 28124-28129(2017).(Link)

F. W. Han(韩方微), W. Xu*, L. L. Li, C. Zhang, H. M. Dong, and F. M. Peeters, Electronic and transport properties of n-type monolayer black phosphorus at low temperatures, Phys. Rev. B 95, 115436 (2017). (Link)

Y. N. Huang(黄衣娜), and W. E. Pickett*, Electronic coupling between a FeSe monolayer film and SrTiO₃ substrate, Phys. Rev. B 95, 165107 (2017).(Link)

Xiaoli Zhang(张小丽), Miaomiao Han, Zhi Zeng* and Yuhua Duan, The role of Sb in solar cell material Cu₂ZnSnS₄, J. Mater. Chem. A 5, 6606(2017).(Link)

Hua Hao(郝华), Ting Jia, Xiaohong Zheng, and Zhi Zeng*, Bias induced spin transitions of spin crossover molecules: the role of charging effect,Phys. Chem. Chem. Phys. 19, 7652 (2017).(Link)

Ya-Min Quan(全亚民), Xiang-Long Yu, Qing-Wei Wang, Liang-Jian Zou*, Competing roles of longitudinal and transverse Hund’s terms on Mott transitions,Annals of Physics377, 197-209(2017).(Link)

Da-Yong Liu(刘大勇)*, Zhe Sun, and Liang-Jian Zou*, Coexistence of localized and itinerant magnetism in intercalated iron-selenide (Li,Fe)OHFeSe, New J. Phys. 19, 023028 (2017). (Link)

 Sunchao Huang(黄孙超), Yongsheng Zhang, Xiaoli Zhang, Zongguo Wang, Xiaoyu Yang and Zhi Zeng, Mechanical properties of zirconium-based random alloys: Alloying elements and composition dependencies,Computational Materials Science 127, 60-66(2017).(Link)

Xiaohong Zheng(郑小宏), Xiaobin Chen, Lei Zhang, Liantuan Xiao, Suotang Jia, Zhi Zeng, and Hong  Guo, Perfect spin and valley polarized quantum transport in twisted SiC  nanoribbons, 2D Materials4, 025013 (2017)(Link).  

Yonggang Li(李永钢), Yang Yang, Michael P. Short, Zejun Ding, Zhi Zeng and Ju Li, Ion radiation albedo effect: influence of surface roughness on ion implantation and sputtering of materials, Nucl. Fusion57, 016038(2017)(Link)

Xia Liu, *Jiaxing Li, Xiaohua Wu, Zhi Zeng, *Xianlong Wang（王贤龙), Tasawar Hayat, Xiaodong Zhang, Adsorption of carbon dots onto Al₂O₃ in aqueous: Experimental and theoretical studies, Environmental Pollution 227, 31-38(2017) (Link)

L. L. Li(李龙龙),* D. Moldovan, P. Vasilopoulos, and F. M. Peeters, Aharonov-Bohm oscillations in phosphorene quantum rings, PHYSICAL REVIEW B 95, 205426 (2017). (link)

L. L. Li(李龙龙),* D. Moldovan, W. Xu, and F. M. Peeters, Electronic properties of bilayer phosphorene quantum dots in the presence of perpendicular electric and magnetic fields, PHYSICAL REVIEW B 96, 155425 (2017). (link)

Chao Zhang(张超), Hoyeon Jeon, Myungchul Oh, Minjun Lee, Sungmin Kim, Sunwouk Yi, Hanho Lee, Inhae Zoh, Yongchan Yoo, and Young Kuk*, Development of a wideband amplifier for cryogenic scanning tunneling microscopy, Rev. Sci. Instrum. 88, 066109 (2017). (link)

Long Ma, Hui Han, Wei Liu, Kaishuai Yang(杨开帅), Yuanyuan Zhu, Changjin Zhang, Li Pi, Dayong Liu(刘大勇)*, Lei Zhang*, and Yuheng Zhang, Opposite pressure effects in the orbitally-induced Peierls phase transition systems CuIr2S4 and MgTi2O4, Dalton Trans. 46, 6708 (2017). (Link)

Peng-Lai Gong, Bei Deng, Liang-Feng Huang, Liang Hu, Wei-Chao Wang, Da-Yong Liu(刘大勇)*, Xing-Qiang Shi*, Zhi Zeng(曾雉), and Liang-Jian Zou(邹良剑)*, Robust and Pristine Topological Dirac Semimetal Phase in Pressured Two-Dimensional Black Phosphorus, J. Phys. Chem. C 121, 20931 (2017). (Link)

HuaiBao Tang*, Guang Li, Qun Yang, XueQing Zuo, HaiJun Zhang, and DaYong Liu(刘大勇)*, Pressure-induced metallic ferromagnetism in antiferromagnetic insulator LaMnAsO, J. Phys.: Conf. Ser. 827, 012013 (2017). (Link)

Tianhua Zou, Tiantian Jia(贾甜甜), Wenjie Xie,* Yongsheng Zhang(张永胜),* Marc Widenmeyer, Xingxing Xiao and Anke Weidenkaff，Band structure modification of the thermoelectric Heusler-phase TiFe2Sn via Mn substitution, Physical Chemistry Chemical Physics 19(28), 18273(2017). (Link)

赵哲, 李永钢, 张传国, 曾雉*,  铁和钨中晶界对材料辐照损伤影响的理论模拟, 深圳大学学报理工版 34, 521-525 (2017). （Link)

S.Q. Jia (贾世庆), Q.W. Wang, J. Liu, and L.J. Zou*, Possible three-dimensional superconducting properties of strongly correlated honeycomb compound In3Cu2VO9, J. Phys. Conf. Series827, 012010 (2017). (Link)

Zihang Liu, Yongsheng Zhang（张永胜）, Jun Mao, Weihong Gao, Yumei Wang, Jing Shuai, Wei Cai, Jiehe Sui, Zhifeng Ren, The microscopic origin of low thermal conductivity for enhancedthermoelectric performance of Yb doped MgAgSb, Acta Materialia128, 227-234 (2017)(Link)

Yizhe Yuan*，Xiaoyong Guo, Liquan An, and Wen Xu(徐文), Terahertz planar waveguide devices based on graphene,Modern Physics Letters B 31, No. 5, 1750045 (2017).(Link)

L. L. Li*(李龙龙）, D. Moldovan, W. Xu, and F. M. Peeters, Electronic properties of bilayer phosphorene quantum dots in the presence of perpendicular electric and magnetic fields, Phys. Rev. B 96, 155425 (2017) (Link)

L. L. Li*(李龙龙), M. Zarenia*, W. Xu, H. M. Dong, and F. M. Peeters*, Exciton states in a circular graphene quantum dot: Magnetic field induced intravalley to intervalley transition, Phys. Rev. B 95, 045409 (2017).(Link)

L. L. Li*（李龙龙), D. Moldovan*, W. Xu, and F. M. Peeters*, Electric- and magnetic- field dependence of the electronic and optical properties of phosphorene quantum dots, Nanotechnology 28, 085702 (2017).(Link)

Shi-Qing Jia(贾世庆), Qing-Wei Wang, Xiang-Long Yu, and Liang-Jian Zou*, Anomalous spin disordered properties of strongly correlated honeycomb compound In₃Cu₂VO_9, AIP Advances 7, 055825 (2017).(Link)

Xiaobin Chen, Chenyi Zhou, Zhaohui Zhang,  Jingzhe Chen, Xiaohong Zheng(郑小宏), Lei Zhang, Chanming Hu, and Hong Guo, Enhancing spin transfer torque in magnetic tunnel junction by ac modulation, Phys. Rev. B 95，115417 (2017). (Link)    

Xiao Dong, et al. A stable compound of helium and sodium at high pressure. Nature Chemistry, 9 (5), 440-5. (2017) (Link)

Cheng Ji, et al. Stability of Ar(H₂ )₂ to 358 GPa. Proceedings of the National Academy of Sciences, 114 (14), 3596-600. (2017) (Link)

Xiao-Di Liu, et al. Comment on “Observation of the Wigner-Huntington transition to metallic hydrogen”. Science, 357 (6353), eaan2286. (2017) (Link)

Xiao-Di Liu*,  et al. High-Pressure Behavior of Hydrogen and Deuterium at Low Temperatures. Physical Review Letters, 119 (6), 065301. (2017) (Link)

Ling-Ping Xiao*, Zhi Zeng*, Xiao-Jia Chen. Structural and electronic properties of solid naphthalene under pressure: density functional calculations. The European Physical Journal B, 89 (6), 142. (2016) (Link)

Yansun Yao, et al. High-pressure phase transition of alkali metal–transition metal deuteride Li₂ PdD₂. The Journal of Chemical Physics, 146 (23), 234506. (2017) (Link)