2020年 [72] Xiaolin Guo, Haiming Duan*, Biaobing Cao, Shuwei Lu, Ablat Abliz, Zhaofeng Wu, Fengjuan Chen, Xuan Chen, Zhenzhen Miao, Mengqiu Long “Cd12O12 cage cluster assembly nanowires and band gap regulation：A first-principles investigation” Phys. Lett. A384, 126463 (2020) [71] Xiaolin Guo, Haiming Duan*, Biaobing Cao, Shuwei Lu, Mengqiu Long, Fengjuan Chen, Ablat Abliz, Zhaofeng Wu, Qun Jing, Zhenzhen Miao, Xuan Chen “Adsorption of small moleculars on Rh3X (X = 3d, 4d atoms) clusters: A DFT study” Mol. Phys. 118(17) e1746424 (2020) [70] Zhenzhen Miao, Can Cao, Bei Zhang, Haiming Duan*, Mengqiu Long* “First-principles study on the effects of doping and adsorption on the electronic and magnetic properties of diamond nanothreads” Physica E 118, 113949 (2020) [69] Zhenzhen Miao, Can Cao, Bei Zhang, Haiming Duan*, Mengqiu Long* “Effects of 3d-transition metal doping on the electronic and magnetic properties of one-dimensional diamond nanothread” Chin. Phys. B 29(6): 066101 (2020) [68] Weiyu Zhang, Zhaofeng Wu*, Xinpeng Zhang, Karimay Abdurahman, Yali Cao, Dianzeng Jia*, Haiming Duan* "Mechanical, electromagnetic shielding and gas sensing properties of flexible cotton fiber/polyaniline composites" Composites Science and Technology, 188, 107966 (2020) [67] Weiyu Zhang, Zhaofeng Wu*, Jindou Hu, Yali Cao, Jixi Guo, Mengqiu Long, Haiming Duan*, Dianzeng Jia* "Flexible chemiresistive sensor of polyaniline coated filter paper prepared by spraying for fast and non-contact detection of nitroaromatic explosives" Sensors & Actuators: B. Chemical, 304, 127233 (2020) [66] Weiyu Zhang, Shuai Cao, Zhaofeng Wu*, Min Zhang, Yali Cao, Jixi Guo, Furu Zhong, Haiming Duan*, Dianzeng Jia* “High-Performance Gas Sensor of Polyaniline/Carbon Nanotube Composites Promoted by Interface Engineering” Sensors, 20, 149 (2020) [65] Aerzigu Xukeer, Zhaofeng Wu*, Qihua Sun, Furu Zhong, Min Zhang, Mengqiu Long*, Haiming Duan* “Enhanced gas sensing performance of perovskite YFe1-xMnxO3 by doping manganese ions” RSC Advances, 10, 30428 (2020) [64] Ablat Abliz*, Da Wan*, Linyu Yang, Henglei Chen, Haiming Duan, Lei Xu "Investigation of the Electrical Properties and Stability of HfInZnO Thin-Film Transistors" Chin. J. Phys. (Accepted) [63] Xuerui Shi, Qun Jing*, Zhaohui Chen, Ming-Hsien Lee, Haiming Duan, Hanqin Ding* “Different mechanism of response of asymmetric lone pair electrons around ns2 cations to birefringence and second harmonic generation” J. Appl. Phys. 128, 113104 (2020) [62] Haitao Liu, Haibin Cao, Xiuhua Cui*, Haiming Duan, Qun Jing, Qian Wang* “The geometry, electronic and magnetic properties of VLin(n = 2–13) clusters using the first-principles and PSO method” Mol. Phys. https://doi.org/10.1080/00268976.2020.1791990 [61] Fengjuan Chen, Xuekun Jin, Dianzeng Jia, Yali Cao, Haiming Duan, Mengqiu Long “Facile synthesis of Ag/CdS composites with improved photocatalytic performance” Materials Research Bulletin, 132, 110987 (2020) [60] Ablat Abliz*, Da Wan*, Haiming Duan, Linyu Yang, Mamatrishat Mamat, Henglei Chen, Lei Xu "Low-Frequency Noise in High Performances and Stability of Li-doped ZnO Thin-Film Transistors" J. Phys. D: Appl. Phys., 53, 415110 (2020) [59] Lu Li, Xiuhua Cui, Haibin Cao, Yi Jiang, Haiming Duan, Qun Jing, Jing Liu, Qian Wang “Structural evolution and magnetic properties of ScLin (n=2~13) clusters: A PSO and DFT investigation” Chin. Phys. B 29(7): 077101 (2020) [58] Xuekun Jin, Fengjuan Chen, Dianzeng Jia, Yali Cao, Haiming Duan, Mengqiu Long “A facile strategy for the fabrication of noble metal/ZnS composites with enhanced photocatalytic activities” RSC Advances, 10, 4455-4463 (2020) [57] Aihemaitijiang Sidike, Guanghua Guo, Dongde Li, Yaozhuang Nie, Biaobing Cao, Haiming Duan, Mengqiu Long “Spin Dependent Electronic Transport Properties of Zigzag Black Phosphorene Nanojunctions Induced by H, Li, O, Co Asymmetric Edge saturations” Phys. Lett. A384, 126123 (2020) [56] Fengjuan Chen*, Xuekun Jin, Dianzeng Jia*, Yali Cao, Haiming Duan, Mengqiu Long “Efficient treament of organic pollutants over CdS/graphene composites photocatalysts” Applied Surface Science, 504, 144422 (2020) 2019年 [55] Chuanchuan Zhang, Haiming Duan*, Xin Lv, Biaobing Cao, Ablat Abliz, Zhaofeng Wu*, Mengqiu Long “Static and dynamical Isomerization of Cu38 clusters” Scientific Reports, 9, 7564 (2019) [54] Qihua Sun, Zhaofeng Wu*, Yali Cao, Jixi Guo, Mengqiu Long, Haiming Duan*, Dianzeng Jia* "Chemiresistive Sensor Arrays based on Noncovalently Functionalized Multi-Walled Carbon Nanotubes for Ozone Detection " Sensors and Actuators B: Chemical, 297, 126689 (2019) [53] Qihua Sun, Zhaofeng Wu*, Haiming Duan*, Dianzeng Jia* "Detection of triacetone triperoxide (TATP) precursors with an array of sensors based on MoS2/RGO composites" Sensors, 19, 1281 (2019) [52] Qiaoqiao Zhang, Hahaer Mushahali, Haiming Duan*, Ming-Hsien Lee, Qun Jing* "The linear and nonlinear optical response of CsGeX3 (X=Cl, Br, and I): The finite field and first-principles investigation" Optik 179, 89-98 (2019) [51] Hongying Bian, Haiming Duan*, Bowen Zeng, Fengjuan Chen, Qun Jing, Biaobin Cao, Mengqiu Long* "Electronic and magnetic properties of the transition-metal absorbed blue-phosphorus/MoS2 heterostructure: A first-principles investigation" AIP Advances, 9, 065207 (2019) [50] Ablat Abliz*, Da Wan, Linyu Yang, Mamatrishat Mamat, Henglei Chen, Lei Xu, Chunlan Wang, Haiming Duan* "Investigation on the electrical performances and stability of W-doped ZnO thin-film transistors" Materials Science in Semiconductor Processing, 95, 54-58 (2019) [49] Ablat Abliz, Lei Xu*, Da Wan, Haiming Duan, Jingli Wang, Chunlan Wang, Shijun Luo, Chuansheng Liu* "Effects of Yttrium Doping on the Electrical Performances and Stability of ZnO Thin-Film Transistors" Applied Surface Science, 475, 565-570 (2019) [48] Zhuanhui Yue, Qiang Li*, Wenbiao Zhang, Mingcan Li, Haiming Duan, Chuntao Chang, Hongxiang Li "Effect of mutual substitution of Fe and Ni elements on the plasticity of Fe/Ni-based amorphous alloys: Ab initio molecular dynamics simulations" J. Non-Cryst. Solids, 514, 46-51 (2019) [47] Xuekun Jin, Fengjuan Chen, Dianzeng Jia, Yali Cao, Haiming Duan, Mengqiu Long, Linyu Yang "Influences of synthetic conditions on the photocatalytic performance of ZnS/graphene composites" Journal of Alloys and Compounds, 780, 299-305 (2019) [46] Dongde Li, Xiaojiao Zhang, Mingjun Li, Haiming Duan, Bingchu Yang, Mengqiu Long "Spin-dependent transport properties of debrominated tetrabromopolyaromatic with Cu or Co doping embedded between zigzag graphene nanoribbon electrodes" Phys. Lett. A383, 2185-2192 (2019) 2018年 [45] Linna Shao, Zhaofeng Wu*, Haiming Duan*, Talgar Shaymurat “Discriminative and rapid detection of ozone realized by sensor array of Zn2+ doping tailored MoS2 ultrathin nanosheets” Sensors and Actuators B: Chemical, 258, 937-946 (2018) [44] Qiaoqiao Zhang, Qun Jing*, Haiming Duan*, Haibin Cao " The relationship between covalent bonds and the optical response in a nonpolar family ATeMoO6 (A=Mg, Zn, Cd): A Berry-Phase investigation " J. Solid State Chem., 264, 22-28 (2018) [43] Luohong Shi, Qiang Li*, Haiming Duan*, Wenbiao Zhang, Weiming Yang, Hongxiang Li, Chuntao Chang "The correlation between mechanical properties and structure of Fe-Ni-P-B amorphous alloys: Ab initio molecular dynamics simulations" J. Non-Cryst. Solids, 491, 1-6 (2018) [42] Xiangping Chen, Haiming Duan*, Biaobing Cao, Mongqiu Long “The global optimization of Pt13 cluser using the first-principles molecular dynamics with the quenching technique” Journal of Statistical Physics, 171(3), 427-433 (2018) [41] Jun Zhang, Weixin Kong*, Haiming Duan* “The directed self-assembly of amphiphilic diblock Copolymers in selective solvents” J. Disper. Sci. Technol., 39(3), 326-332 (2018) [40] Jialin Li,Haiming Duan,Bowen Zeng,Qun Jing,Biaobin Cao,Fengjuan Chen,Mengqiu Long* "Strain-Induced Band Structure Modulation in Hexagonal Boron Phosphide/Blue Phosphorene vdW Heterostructure" J. Phys. Chem. C, 122, 26120-26129 (2018) [39] Shidong Zhang, Xiaojiao Zhang, Mingjun Li*, Bowen Zeng, Haiming Duan, Dan Zhang, Mengqiu Long* “Study on the electronic structures and transport properties of the polyporphyrin nanoribbons with different edge configurations” Phys. Lett. A382(38), 2769-2775 (2018) [38] Ablat Abliz, Da Wan, Jui-Yuan Chen, Lei Xu, Jiawei He, Yanbing Yang, Haiming Duan, Chuansheng Liu, Changzhong Jiang, Huipeng Chen, Tailiang Guo, and Lei Liao "Enhanced Reliability of InGaZnO Thin-Film Transistors through Design of Dual Passivation Layers" IEEE Transactions on Electron Devices, 65(7), 2844-2849 (2018) [37] Dongde Li, Di Wu, Xiaojiao Zhang, Bowen Zeng, Mingjun Li, Haiming Duan, Bingchu Yang, Mengqiu Long "The spin-dependent electronic transport properties of M(dcdmp)2(M=Cu, Au, Co, Ni) molecular devices based on zigzag graphene nanoribbon electrodes" Phys. Lett. A382(21), 1401-1408 (2018) [36] Bowen Zeng, Mengqiu Long, Xiaojiao Zhang, Yulan Dong, Mingjun Li, Yougen Yi; Haiming Duan "Strain engineering on electronic structure and carrier mobility in monolayer GeP3" Journal of Physics D: Applied Physics, 51(23), 235302 (2018) 2017年 [35] Xuefang Xie, Jun Sun, Biaobing Cao, Haiming Duan* “Geometrical and electronic structures of small Co-Mo nanoclusters” RSC Advances, 7, 4933-4940 (2017) [34] Jun Sun, Xuefang Xie, Biaobing Cao, Haiming Duan* “A density-functional theory study of Au13, Pt13, Au12Pt and Pt12Au clusters” Comput. Theor. Chem., 1107, 127-135 (2017) [33] Y.Y. Jiang, X. F. Xie, I. Hamid, C. Chen*, H. M. Duan* “Theoretical simulation of CO2 capture by Al11Mg3- cluster” Mater. Res. Express, 4(4), 046302 (2017) [32] Jiawei Jiang, Qiang Li*, and Haiming Duan*, Hongxiang Li “The effects of metalloid elements (P, C, B) on the properties of Co-based amorphous alloys studied by ab initio molecular dynamics simulations” Comp. Mater. Sci., 130, 76-83 (2017) [31] Di Wu, Qiang Li*, and Haiming Duan* “Ab initio molecular dynamics simulation on the glass forming ability of Ni-metalloid amorphous alloys” J. Non-Cryst. Solids, 461, 87-92 (2017) [30] Jun Zhang, Weixin Kong*, Haiming Duan “Soft Confinement-Induced Morphologies of the blends of AB diblock Copolymers and C homopolymers” Langmuir, 33(12), 3123-3133 (2017) [29] Zhaofeng Wu, Haiming Duan, Zhijun Li*, Jixi Guo, Furu Zhong, Yali Cao*, Dianzeng Jia* “Multichannel Discriminative Detection of Explosive Vapors with an Array of Nanofibrous Membranes Loaded with Quantum Dots” Sensors, 17(11), 2676 (2017) 2016年 [28] Jingjing Zhang, Jun Sun, Yanqi Liu, Jiao Li, Xiaogang Liang, Haiming Duan* “The first-principles study of Al12X (X = Sc-Zn) clusters and their adsorption of H, O and N” AIP Advances, 6, 075312 (2016) [27] Xiaogang Liang, Ilyar Hamid, Haiming Duan* “Dynamical stabilities of the icosahedral-like clusters and their ability to form quasicrystals” AIP Advances, 6, 065017 (2016) [26] Yanqi Liu, Jingjing Zhang, Jiao Li, Xiaogang Liang, Haiming Duan* “Hydrogen, oxygen and nitrogen adsorption on Rhn-1X (n = 2–5, X = 3d, 4d atoms) clusters: A DFT study” Comput. Theor. Chem., 1085, 56-65 (2016) [25] Jiao Li, Yanqi Liu, Jingjing Zhang, Xiaogang Liang, Haiming Duan* “Density functional theory study of the adsorption of hydrogen atomson Cu2X (X = 3d) clusters” Chem. Phys. Lett., 651, 137-143 (2016) 2015年及以前 [24] Ilyar Hamid, Meng Fang, Haiming Duan* “Molecular dynamical simulations of melting behaviors of metal clusters” AIP Advances, 5, 047129 (2015) [23] Wenbiao Zhang, Qiang Li*, and Haiming Duan* “Study of the effects of metalloid elements (P, C, B) on Fe-based amorphous alloys by ab initio molecular dynamics simulations” J. Appl. Phys., 117, 104901 (2015) [22] Chu Chen, Weixin Kong, Hai-Ming Duan and Jun. Zhang “Theoretical simulation of the reduction of graphene oxide by lithium naphthalenide” Phys. Chem. Chem. Phys., 17, 13654-13658 (2015) [21] Chu Chen, Weixin Kong, Hai-Ming Duan and Jun. Zhang “Theoretical simulation of reduction mechanism of graphene oxide in sodium hydroxide solution” Phys. Chem. Chem. Phys., 16, 12858-12864 (2014) [20] C. Chen, J. Zhang, B. Zhang, H. M. Duan “Hydrogen Adsorption of Mg Doped Graphene Oxide: A First-Principles Study” J. Phys. Chem. C, 117, 4337-4344 (2013) [19] B. Zhang*, B. B. Cao, C. Chen, J. Zhang, H. M. Duan* “Density-functional theory study on neutral and charged MnC2 (M=Fe, Co, Ni, Cu, n=1-5) clusters” Journal of Cluster Science, 24, 197-207 (2013) [18] 李春丽，段海明*，买力坦.开来木 “Aln(n=13-32)团簇熔化行为的分子动力学模拟研究” 物理学报，62(19), 193104-1-193104-7页, 2013年10月 [17] Haiming Duan, Xiang Gao, Guanjian Fu, Jiaming Li “Theoretical investigation of encapsulation processes of C60 into single-wall carbon nanotubes” Phys. Lett. A375, 1412 (2011) [16] 吴洋，段海明* “采用Lennard-Jones原子间势研究(C60)N分子团簇的结构演化行为” 物理学报，60(7), 076102-1-076102-6页, 2011年7月 [15] 鄂箫亮，段海明* “Gupta势结合遗传算法研究ConCu55-n（n=0～55）混合团簇的结构演化及基态能量” 物理学报，59(8), 5672-5680页, 2010年8月 [14] 刘建廷，段海明* “不同势下铱团簇结构和熔化行为的分子动力学模拟” 物理学报，58(7), 4826-4834页, 2009年7月 [13] Shuwei Lu, Jun Zhang, Haiming Duan* “Melting behaviors of CoN (N=13, 14, 38, 55, 56) clusters” Chem. Phys. 363(1-3), 7-12 (2009) [12] Kim Bolton, Feng Ding, Anders Börjesson, Wuming Zhu, Haiming Duan, Arne Rosén, Avetik R. Harutyunyan and S. Curtarolo “Computational studies of catalytic particles for carbon nanotube growth” J. Comput. Theor. Nanosci. 6, 1–15 (2009) (Invited Review article) [11] Wuming Zhu, Haiming Duan , Kim Bolton “Diameter and Chirality Changes of Single-Walled Carbon Nanotubes During Growth: An ab-initio Study” J. Nanosci. Nanotechnol. , 9（2）, 1222-1225（2009） [10] Haiming Duan, Arne Rosén, Avetik Harutyunyan, Stefano Curtarolo, and Kim Bolton “Computational Studies of Small Carbon and Iron-Carbon Systems Relevant to Carbon Nanotube Growth” J. Nanosci. Nanotechnol. , 8（11）, 6170-6177（2008） [9] Z.X. Zhang, B.B. Cao, H.M. Duan* “Density-functional calculations of MnC(M=Fe,Co,Ni,Cu,n=1-6)clusters” Journal of Molecular Structure: THEOCHEM 863, 22 – 27（2008） [8] Lin He & Duan Haiming* “Local electronic structure and magnetic properties of 3d transition metal doped GaAs” Sci China Ser G-Phys Mech Astron , vol. 51, no. 5, 470-480，May (2008) [7] Feng Ding, Peter Larsson, J. Andreas Larsson, Rajeev Ahuja, Haiming Duan, Arne Rosén, Kim Bolton “The Importance of Strong Carbon-Metal Adhesion for Catalytic Nucleation of Single-Walled Carbon Nanotubes” Nano Lett. 8, 463 -468(2008) (Reported as a ‘Research Highlight’ in Nature Nanotechnology-http://www.nature.com/nnano/reshigh/2008/0108/full/nnano.2008.21.html). [6] Haiming Duan* , Feng Ding, Arne Rosén, Avetik R. Harutyunyan, Toshio Tokune, Stefano Curtarolo, Kim Bolton “Size dependent melting mechanisms of iron nanoclusters” Chem. Phys. 333, 57-62(2007) [5] Peter Larsson, J. Andreas Larsson, Rajeev Ahuja, Feng Ding, Boris Yakobson, Haiming Duan* ,Arne Rosén, Kim Bolton “Calculating carbon nanotube – catalyst adhesion strengths” Phys. Rev. B 75, 115419 (2007) selected by Virtual Journal of Nanoscale Science Technology, 15, 13 (2007) [4] Haiming Duan* , Feng Ding, Arne Rosén, Avetik R. Harutyunyan, Toshio Tokune, Stefano Curtarolo, Kim Bolton “Initial growth of single-walled carbon nanotubes on supported iron clusters: a molecular dynamics study”. Euro. Phys. J. D 43, 185 (2007) [3] Lin He & Duan Haiming* Local electronic structure and magnetic properties of (Ga,Cr)N Chinese Science Bulletin Vol. 51 No. 13, 1546—1550 (2006) [2] H. M. Duan*, X. G. Gong, Q .Q. Zheng and H. Q. Lin, “Electronic structure and magnetic properties of Ni clusters”, J. Appl. Phys. 89, 7308 (2001). [1] H. M. Duan* and Q. Q. Zheng, “Symmetry and magnetic properties of transition metal clusters”, Phys. Lett. A280, 333 (2001). |
