部  门： 物理系

职  称： 教授

邮  箱： kw@xtu.edu.cn

办公室：物理楼511

张凯旺，二级教授，博士生导师，中共党员，一直致力于计算凝聚态物理、量子薄膜生长及其热力学性质和量子动力学等多方面的研究，特别是在二维纳米结构的热稳定性与超塑性及高温位错动力学、纳米材料表面金属量子点阵的成核与生长机理以及奇异量子动力学等研究做出了可喜的成绩，利用分子动力学在纳米材料的预溶化和纳米压痕模拟等方面的研究处于国际前沿，在二维异质结高温形变行为动力学研究和二维纳米薄膜异构体复合结构的结构稳定性、电子性质和压电效应等的研究方向形成了优势和特色，先后发表SCI学术论文70余篇，参与获省部级科技进步奖2项，研究成果多次在国际国内学术会议上报告或邀请报告。

学习工作经历

1985.7—至今  湘潭大学   任教

2005.9—2008.6  湘潭大学 物理与光电工程学院   凝聚态物理专业 博士毕业

1981.9—1985.6  湘潭大学 物理学专业 本科毕业

研究方向

计算物理

科研项目

主持完成2项国家自然科学基金面上项目，2项湖南省教育厅重点研究项目，2项湖南省教育厅委托研究项目，1项省自然科学基金研究项目。

代表性成果（专著、论文和专利等）

1.           Qing-Yu Xie, Peng-Fei Liu, Jiang-Jiang Ma,   Li-Ming Wu, Kai-Wang Zhang*, Bao-Tian Wang*, Microscopic mechanisms of   glasslike lattice thermal conductivity in tetragonal α-CsCu₅Se₃,   Physical Review B, 2023.7.10, 108: 014302

2.           Hong Zhang, QingYu Xie, Kaiwang Zhang*, Electronic   structures and optical properties of Janus GeXY (X, Y = P, As and Sb): First-principles   predictions, Applied Physics Express, 2023.5.17, 16: 052005

3.           Qing-Yu Xie, Jiang-Jiang Ma, Qing-Yi Liu,   Peng-Fei Liu, Pei Zhang, Kaiwang Zhang*, Bao-Tian Wang*, Low thermal   conductivity and high performance anisotropic thermoelectric properties of   XSe (X = Cu, Ag, Au) monolayers, Physical Chemistry Chemical Physics,   2022.03.02, 24: 7303~7310

4.           Qing-Yu Xie, Peng-Fei Liu, Jiang-Jiang Ma,   Fang-Guang Kuang, Kai-Wang Zhang*, Bao-Tian Wang*, Monolayer SnI₂:   An Excellent p-Type Thermoelectric Material with Ultralow Lattice Thermal   Conductivity, Materials 2022.4.26, 15: 3147

5.           Song Wu, Kaiwang Zhang*, Jiabin Li, Teng   Zhong, Boron and nitrogen edges modify the thermal conductivity of   phagraphene nanoribbons: Molecular dynamics simulations, Computational   Materials Science, 2020.10.14, 1187: 110084

6.           Hansi Ma, Junbo Yang, Jie Huang, Zhaojian   Zhang, Kaiwang Zhang*, Inverse-designed single-mode and multi-mode   nanophotonic waveguide switches based on hybrid silicon-Ge2Sb2Te5 platform,   Results in Physics, 2021, 26: 104384

7.           Hansi Ma, Jie Huang, Kaiwang Zhang*, Junbo   Yang*, Inverse-designed arbitrary-input and ultra-compact 1×N power splitters   based on high symmetric structure, Scientific Reports, 2020.7.16, 10:11757

8.           Hansi Ma, Jie Huang, Kaiwang Zhang*, Junbo   Yang*, Ultra-compact and efficient 1×2 mode converters based on rotatable   direct-binary-search algorithm, Optics Express, 2020.5.21, 28(11): 17010

9.           Hansi Ma, Jie Huang, Kaiwang Zhang*, Junbo   Yang*, Arbitrary-direction, multichannel and ultra-compact power splitters by   inverse design method, Optics Communications, 2020.1.18, 462: 125329

10.        Jiabin Li, Chaoyu He*, Kaiwang Zhang*, Jianxin   Zhong, First-principles prediction of a new ground state for surface-oxidized   phosphorene with remarkable piezoelectricity, Journal of Physics D: Applied   Physics, 2019.5.13, 52: 295301

11.        Teng Zhong, Jiabin Li , Kaiwang Zhang*, A   molecular dynamics study of Young's modulus of multilayer graphene, Journal   of Applied Physics, 2019.5.6, 125: 175110

12.        Jiabin Li, Ting Zhao, Chaoyu He*, Kaiwang   Zhang*, Surface oxidation: an effective way to induce piezoelectricity in 2D   black phosphorus, Journal of Physics D: Applied Physics, 2018.2.26, 51:12LT01

13.        Xinjun Tan, Jian Wu, Kaiwang Zhang*, Xiangyang   Peng, Lizhong Sun,Jianxin Zhong, Response to "Comment on   'Nanoindentation models and Young's modulus of monolayer graphene: A   molecular dynamics study'", Applied Physics Letters, 2017.4.27, 110: 176101

14.        ShuangYing Ma，Meng Zhang，L.Z. Sun*，K.W. Zhang*，High-temperature behavior of monolayer graphyne and graphdiyne,   Carbon, 2016.4.01, 99: 547~555

15.        ShuangYing Ma，Pan Zhou，L. Z Sun*，K. W. Zhang*，Two-dimensional tricycle arsenene with a direct band gap，Physical Chemistry Chemical   Physics, 2016.3.28, 18(12): 8723~8729

16.        Cheng Shu，Jinfeng Qu，Xiangyang Peng*，Hong Yang，Wenliang Liu，Xiaolin Wei，Kaiwang Zhang，Jianxin Zhong，The induced nontrivial Z(2) topological phase in graphene   sandwiched by pnictogen bilayers, Journal of Physics: Condensed Matter，2016.6.15, 28(23)

17.        Yongchun Wang，Kaiwang Zhang，Guofeng Xie*，Remarkable suppression of thermal conductivity by   point defects in MoS2 nanoribbons，Applied Surface Science, 2016.1.1, 360: 107~112

18.        ShuangYing Ma，L. Z. Sun*，K. W. Zhang*，Prediction of two planar carbon allotropes with large meshes，Physical Chemistry Chemical   Physics, 2015.12.23, 18(2): 1172~1177

19.        ShuangYing Ma，Chaoyu He，L. Z. Sun*，Haiping Lin，Youyong Li，K. W. Zhang(*)，Stability of two-dimensional PN monolayer sheets and their   electronic properties，Physical Chemistry Chemical Physics, 2015.11.25, 17(47):   32009~32015

20.        T. Zhao，C. Y. He，S. Y. Ma，K. W. Zhang*，X. Y. Peng*，G. F. Xie，J. X. Zhong，A new phase of phosphorus: the missed tricycle type red   phosphorene，Journal   of Physics: Condensed Matter, 2015.7.8, 27(26): 265301~265301

21.        Lang Xiang，Shuang Ying Ma，Fang Wang，Kaiwang Zhang*, Nanoindentation models and Young's modulus of   few-layer graphene: a molecular dynamics simulation study, Journal of Physics   D: Applied Physics, 2015.9.4，48：395305

22.        向浪，吴建，马双英，王芳，张凯旺*，Nanoindentation   Models of Monolayer Graphene and Graphyne under Point Load Pattern Studied by   Molecular Dynamics, Chinese Physics Letters, 2015.4.30，32(9): 096801

23.        Mengting Jin，N. Jiao，H.X. Da，K.W. Zhang，Xiaoshuang Chen，L.Z. Sun*，Anisotropic optical properties of graphene/graphane superlattices,   Solid State Sciences, 2015.2.01，40：71~76

24.        Mengting Jin，N. Jiao，C.X. Zhang，H.P. Xiao，K.W. Zhang，L.Z. Sun*，Reduction mechanism of hydroxyl group from graphene oxide with and   without–NH2 agent，Physica B: Condensed Matter,   2015.11.15, 477: 70~74

25.        ShuangYing Ma，C. X. Zhang，Junjie He，Pan Zhou，K. W. Zhang*，Chaoyu He，L. Z. Sun*，Stable configurations and electronic structures of hydrogenated   graphyne，Computational   Materials Science, 2014.8.01, 91: 274~278

26.        Liu Wu，Zhang Kaiwang*，Wang Ru-Zhi*，Zhong JianXin，Liu Li-Min(*), Modulation of the electron transport properties in   graphene nanoribbons doped with BN chains，AIP Advances，2014.6.01，4(6): 067123

27.        Junjie He，Pan Zhou，N. Jiao，S. Y. Ma，K. W. Zhang，R. Z. Wang，L. Z. Sun*，Magnetic Exchange Coupling and Anisotropy of 3d Transition Metal   Nanowires on Graphyne，Scientific Reports，2014.2.10，4：4014

28.        Guofeng Xie*，Yuan Guo，Xiaolin Wei，Kaiwang Zhang，Phonon mean free path spectrum and thermal conductivity for   Si1-xGex nanowires，Applied Physics Letters，2014.6.9，104：233901

29.        Zhongkai huang，Jinfeng Qu，Xiangyang Peng*，Wenliang Liu，Kaiwang Zhang，Xiaolin Wei，Jianxin Zhong，Quantum confinement in graphene quantum dots，Phys. Status Solidi RRL，2014.3.25，5：436~440

30.        Yulu Shen，Guofeng Xie*，Xiaolin Wei，Kaiwang Zhang，Size and boundary scattering controlled contribution of spectral   phonons to the thermal conductivity in graphene ribbons，Journal of Applied Physics,   2014.2.12，115：063507

31.        Chen Yan-Li，Peng Xiang-Yang*，Yang Hong，Chang Sheng-Li，Zhang Kai-Wang，Zhong Jian-Xin，Stacking effects in topological insulator Bi2Se3: a   first-principles study，Acta Physica Sinica，2014.9.20，63(18): 416~422

32.        X. J. Tan，J. Wu，K.   W. Zhang*，X. Y.   Peng*，L. Z. Sun，J. X. Zhong，Nanoindentation models and   Young‘s modulus   of monolayer graphene: A molecular dynamics study，Applied Physics Letters,   2013.2.21，102：071908

33.        J. Wu，K. W. Zhang*，X. Y. Peng，S. M. Li，L. Z. Sun，J. X. Zhong，A molecular dynamics study of the Si-nanowire@carbon-nanotube   nanocomposite with sp(3) interfacial bonding，Computational Materials Science，2013.11.01，79：650~655

34.        S. M. Li，J. Wu，W.   Wang，K. W. Zhang*，X. Y. Peng，L. Z. Sun，J. X. Zhong，Carbon nanotube oscillators   encapsulating a platinum nanocluster: A molecular dynamics study，Physica E: Low-Dimensional   Systems and Nanostructures，2013.12.01，54：237~241

35.        Xie Guofeng*，Guo Yuan，Li Baohua，Yang Liwen，Zhang Kaiwang，Tang Minghua，Zhang Gang，Phonon surface scattering controlled length dependence of thermal   conductivity of silicon nanowires.，Physical Chemistry Chemical Physics，2013.9.21，15(35): 14647~14652

36.        Xiao Huaping，Zhang Chuanxiao，Zhang Kaiwang，Sun Lizhong*，Zhong Jianxin*，Tunable differential conductance of single wall   C/BN nanotube heterostructure.，J Mol Model，2013.8.01，19(8): 2965~2969

37.        X. Y. Li，K. W. Zhang*，X.Y. Peng*，S. M. Li，X. J. Tan，J. X. Zhong，Dynamical behavior of the kink motion in carbon nanotubes，European Physical Journal B，2012.1.8，85：64

38.        杜玉光，张凯旺*，彭向阳，金福报，钟建新，碳纳米管内Ni纳米线的螺旋度与热稳定性研究，Acta Physica   Sinica，2012.9.5，61(17): 176102

39.        Chaoyu He，Lizhong Sun*，Chunxiao Zhang，Xiangyang Peng，Kaiwang Zhang，Jianxin Zhong*，Z-BN: a novel superhard boron nitride phase，Physical Chemistry Chemical   Physics, 2012.01.01，14(31): 10967~10971

40.        H. P. Xiao，Chaoyu He，Chunxiao Zhang，L. Z. Sun*，Xiangyang Peng，Kaiwang Zhang，Jianxin Zhong*，Size effect of half-metallic properties of BN/C hybrid nanoribbons，Physica B: Condensed Matter，2012.12.15，407(24): 4770~4772

41.        C.X. Zhang，H.P. Xiao，C.Y. He，L. Xue，K. W. Zhang，L. Z. Sun*，J. X. Zhong*，Effects of contact oxidization on the transport properties of   Au/ZGNR junctions，Physica Status Solidi-Rapid Research Letters，2012.11.5，6(12): 457~459

42.        C.Y. He，C.X. Zhang，L. Z. Sun*，N. Jiao，K. W. Zhang，J. X. Zhong*, Structure, stability and electronic properties of   tricycle type graphane，Physica Status Solidi-Rapid Research Letters, 2012.9.27，6(11): 427~429

43.        He Chaoyu，Sun Lizhong*，Zhang Chunxiao，Peng Xiangyang，Zhang Kaiwang，Zhong Jianxin*，New superhard carbon phases between graphite and diamond，Solid State Communications,   2012.8.01, 152(16): 1560~1563

44.        C.X. Zhang，C.Y. He，L. Xue，K. W. Zhang，L. Z. Sun*，J. X. Zhong*, Transport properties of zigzag graphene nanoribbons   with oxygen edge decoration，Organic Electronics，2012.7.5，13：2494~2510

45.        N. Jiao，C. Y. He，C. X. Zhang，X. Y. Peng，K. W. Zhang，L. Z. Sun*, Modulation effect of hydrogen and fluorine decoration   on the surface work function of BN sheets，AIP Advances，2012.5.10，2：022125

46.        C. X. Zhang，Chaoyu He，Zhizhou Yu，L. Xue，K. W. Zhang，L. Z. Sun*，Jianxin Zhong*，Effects of oxygen-containing defect complex on the electronic   structures and transport properties of single-walled carbon nanotubes，Physics Letters A，2012.4.16，376(20): 1686~1691

47.        L. J. Meng，X. Y. Peng*，K. W. Zhang，C. Tang，J. X. Zhong*，Structural phase transitions of FeCo and FeNi nanoparticles: A   molecular dynamics study，Journal of Applied Physics，2012.1.19，111：024303

48.        F. B. Jin，K. W. Zhang*，J. X. Zhong，Quantum diffusion in bilateral doped chains，Chinese Physics B，2011.7.15，20(7): 076701

49.        左学云，李中秋，王伟，孟利军，张凯旺*，钟建新，碳纳米管熔接金电极的分子动力学模拟，Acta Physica Sinica，2011.6.15，60(6): 066103

50.        W. L. Liu，X. Y. Peng*，C. Tang，L. Z. Sun，K. W. Zhang，J. X. Zhong*, Anisotropic interactions and strain-induced   topological phase transition in Sb2Se3 and Bi2Se3，Physical Review B，2011.12.9，84：245105

51.        Wei Xiao-Lin*，Zhang Kai-Wang，Wang Ru-Zhi，Liu Wen-Liang，Zhong Jian-Xin，Modified Morphology of Graphene Sheets by Argon-Atom Bombardment:   Molecular Dynamics Simulations，Journal of Nanoscience and Nanotechnology，2011.12.01，11(12): 10863~10867

52.        C. X. Zhang，Chaoyu He，Zhizhou Yu，K. W. Zhang，L. Z. Sun*，Jianxin Zhong*，Transport Properties of Zigzag Graphene Nanoribbons Decorated by   Carboxyl Group Chains，Journal of Physical Chemistry C, 2011.11.10, 115(44): 21893~21898

53.        M. L. Hu，Z. Z. Yu，K. W. Zhang，L. Z. Sun*，J. X. Zhong，Tunneling magnetoresistance of bilayer hexagonal boron nitride and   its linear response to external uniaxial strain，Journal of Physical Chemistry C, 2011.4.6, 115:   8260~8264

54.        J. Chen，K. W. Zhang*，J. X. Zhong，Identifying functional modules of diffuse large B-cell Lymphoma   gene co-expression networks by hierarchical clustering method based on random   matrix theory，Nano   Biomedicine and Engineering，2011.1.18，3(1): 57~64

55.        王伟，张凯旺*，孟利军，李中秋，左学云，钟建新，多壁碳纳米管外壁高温蒸发的分子动力学模拟，Acta Physica Sinica，2010.04.15，59(4): 2672~2678

56.        L. J. Meng，X. Y. Peng*，C. Tang，K. W. Zhang，G. M. Stocks，J. X. Zhong*，A quasicore-shell structure of FeCo and FeNi nanoparticles,   Journal of Applied Physics，2010.11.30，108：104314

57.        Liu Jun-Min，Sun Li-Zhong*，Chen Yuan-Ping，Zhang Kai-Wang，Yuan Hui-Qiu，Zhong Jian-Xin，Electronic structure and bonding mechanism of   La-Ir-Si: A first-principles study，Acta Physica Sinica, 2009.11.01，58(11): 7826~7832

58.        Meng Li-Jun，Xiao Hua-Ping，Tang Chao，Zhang Kai-Wang，Zhong Jian-Xin*，Formation and thermal stability of compound stucture of carbon   nanotube and silicon nanowire，Acta Physica Sinica, 2009.11.01, 58(11): 7781~7786

59.        Liu Wen-Liang*，Zhang Kai-Wang，Zhong Jian-Xin，Thermal stability of silicon nanowires:   atomistic simulation study，Chinese Physics B, 2009.7.01，18(7): 2920~2924

60.        Yue E. Xie*，Yuan Ping Chen，L. Z. Sun，K. W. Zhang，JianXin Zhong，The effect of corner form on electron transport of L-shaped   graphene nanoribbons，Physica B: Condensed Matter, 2009.6.1, 404(12-13): 1771~1775

61.        K. W. Zhang*，Z. Q. Li，J. Wu，X.   Y. Peng，X. J. Tan，L. Z. Sun，J. X. Zhong，Structure, stability, and   motion of dislocations in double-wall carbon nanotubes，Chinese Physics B，2012.10.15，21(10): 106102

62.        Zhang Kai-Wang*，Zhong Jian-Xin，Influence of defects on the melting and   premelting of carbon nanotubes，Acta Physica Sinica, 2008.6.01, 57(6): 3679~3683

63.        Zhang Kai-Wang*，Meng Li-Jun，Li Jun，Liu Wen-Liang，Tang Yi，Zhong Jian-Xin，Structure and thermal stability of gold nanowire encapsulated in   carbon nanotube，Acta   Physica Sinica，2008.7.01，57(7): 4347~4355

64.        Zhang Kai-Wang*，Quantum diffusion in semi-infinite periodic and   quasiperiodic systems，Chinese Physics B，2008.3.01，17(3):1113~1118

65.        Chao Tang*，Lijun Meng，Lizhong Sun，Kaiwang Zhang，Jianxin Zhong*，Molecular dynamics study of ripples in graphene nanoribbons on   6H-SiC(0001): Temperature and size effects，Journal of Applied Physics, 2008.12.1, 104(11):   113536

66.        Li Ai-Hua，Zhang Kai-Wang，Meng Li-Jun，Li Jun，Liu Wen-Liang，Zhong Jian-Xin*，Novel silicon nanostructures based on graphene ribbons，Acta Physica Sinica，2008.7.01，57(7): 4356~4363

67.        李俊，张凯旺，孟利军，刘文亮，钟建新*，碳纳米管表面金纳米颗粒的形成与结构转变，Acta Physica Sinica，2008.1.15，（01）：0382

68.        Kaiwang Zhang，G. Malcolm Stocks，Jianxin Zhong，Melting and premelting of carbon nanotubes，Nanotechnology，2007.7.18，18(28): 285703

69.        Wenliang Liu，Kaiwang Zhang*，Huaping Xiao，Lijun Meng，Jun Li，G. Malcolm Stocks，Jianxin Zhong*，Surface reconstruction and core distortion of silicon and   germanium nanowires, Nanotechnology, 2007.5.30，18(21): 215703

70.        Meng Li-Jun*，Zhang Kai-Wang，Zhong Jian-Xin，Molecular dynamics simulation of formation of   silicon nanoparticles on surfaces of carbon nanotubes，Acta Physica Sinica，2007.2.01，56(2): 1009~1013

71.        Lijun Meng，Kaiwang Zhang，G. Malcolm Stocks，Jianxin Zhong*，Small Si clusters on surfaces of carbon nanotubes，Journal of Applied Physics，2006.12.15，100(12): 126107

荣誉奖励

1.           奇异量子动力学研究；湖南省人民政府，科技进步奖，二等奖，省部级；2005年；排名第2

2.           低维纳米结构的物性与调控；湖南省人民政府，自然科学奖，一等奖，省部级；2013年；排名第6

3.           2016年指导博士生获湘潭大学第二十一届研究生校长优秀奖。

4.           2020年指导硕士生获湘潭大学第二十六届研究生校长奖特等奖

5.           2020年指导硕士生获2020年度高校国家励志奖学金。

6.           2023年指导硕士生获湘潭大学优秀硕士学位论文。