(1) 二碳化钍中压力诱导的结构相变与聚合, Pressure-induced structural transformations and polymerization in ThC2, SCIENTIFIC REPORTS, 2017, 第 11 作者
(2) Ti3SiC2 and Ti3AlC2中空位缺陷的第一性原理研究, First-Principles Study of Vacancies in Ti3SiC2 and Ti3AlC2, MATERIALS, 2017, 第 11 作者
(3) 镍中氦团簇的能量与稳定性:分子动力学模拟, The energy and stability of helium-related cluster in nickel: A study of molecular dynamics simulation, NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2016, 第 11 作者
(4) FLiBe熔盐中的局域结构与振动谱的第一性原理研究, First-principle investigation of the structure and vibrational spectra of the local structures in LiF-BeF2 Molten Salts, JOURNAL OF MOLECULAR LIQUIDS, 2016, 第 11 作者
(5) 镍中螺位错与氦相互作用的原子模拟, Atomistic Simulations of the Effect of Helium on the Dissociation of Screw Dislocations in Nickel, CHINESE PHYSICS LETTERS, 2016, 第 11 作者
(6) 锕系四氟化物的成键本质, Bonding nature of the actinide tetrafluorides AnF(4) (An = Th-Cm), MOLECULAR PHYSICS, 2015, 第 11 作者
(7) 碳化钍新高位相的第一性原理预测, A new phase of ThC at high pressure predicted from a first-principles study, PHYSICS LETTERS A, 2015, 第 4 作者
(8) 金属裂变产物与缺陷石墨的相互作用的理论研究, Theoretical study of the interaction between metallic fission products and defective graphite, COMPUTATIONAL MATERIALS SCIENCE, 2015, 第 11 作者
(9) 碳化钍的晶格动力学与晶格热输运, Lattice dynamics and lattice thermal conductivity of thorium dicarbide, JOURNAL OF NUCLEAR MATERIALS, 2014, 第 11 作者
(10) An improved DNA force field for ssDNA interactions with gold nanoparticles, JOURNAL OF CHEMICAL PHYSICS, 2014, 第 4 作者
(11) Dynamic correlation of photo-excited electrons: Anomalous levels induced by light-matter coupling, PHYSICA B-CONDENSED MATTER, 2014, 第 11 作者
(12) The effect of temperature on primary defect formation in Ni-Fe alloy, NUCLEAR INSTRUMENTS and METHODS IN PHYSICS RESEARCH SECTION B, 2014, 第 4 作者
(13) Fluorine interaction with defects on graphite surface by a first principles study, Applied Surface Science, 2014, 第 11 作者
(14) Anomalous stability of graphene containing defects covered by a water layer, Nanoscale, 2013, 第 11 作者
(15) Theoretical study on the interaction between graphene divicancies and C2H2, Chemical Physics Letters , 2013, 第 3 作者
(16) Defect Induced Electronic Structure of Uranofullerene, Scientific Reports, 2013, 第 11 作者
(17) Quantum Confinement Effects in Dynamically Screened Quasi-One-Dimensional Systems, Chinese Physics Letters, 2013, 第 11 作者
(18) 掺杂T型半导体量子线的量子限域效应与有效库仑作用, Quantum confinement effect and effective Coulomb interaction in doped T-shaped semiconductor quantum wire, 核技术, 2012, 第 11 作者
(19) T型半导体量子线的动态屏蔽效应, Dynamical screening effect in T-shaped semiconductor quantum wire, 核技术, 2012, 第 11 作者
(20) 碳纳米管中的低能离子沟道的电荷与质量效应, Charge and Mass Effects on Low Energy Ion Channeling in Carbon Nanotubes, CHINESE PHYSICS LETTERS, 2011, 第 11 作者
(21) 一维Hubbard-Holstein模型中的角分辨光电子谱, Angle-resolved photoemission spectra in one-dimensional Hubbard-Holstein model, Nuclear Science and Techniques, 2011, 第 11 作者
(22) 量子线激光中载流子诱导的稳定峰值增益压制现象, Robust Carrier-Induced Suppression of Peak Gain Inherent to Quantum-Wire Lasers, Journal of the Physical Society of, 2011, 第 2 作者
(23) 石墨烯带中金原子的迁徙:边缘的角色, Migration of gold atoms in graphene ribbons: Role of the edges, Physical Review B, 2010, 第 11 作者
(24) 碳纳米管异质结中热输运的理论研究, Theoretical study of heat conduction in carbon nanotube hetero-junctions, Physics Letters A, 2010, 第 11 作者
(25) 轴向应力下单壁碳纳米管的输运, Thermal Conductivity of Single-Walled Carbon Nanotubes under Axial Stress, Journal of Physical Chemistry C, 2010, 第 11 作者
(26) 基于不同作用势模型的单臂碳纳米管声学声子传播的理论研究, Theoretical Study on the Propagation of Acoustic Phonon Modes in Single-Wall Carbon Nanotubes by Different Potential Models, Chinese Physics Letters, 2009, 第 3 作者
(27) 单壁碳纳米管中多种离子辐照损伤的分子动力学研究, Molecular dynamics study of damage production in single-walled carbonnanotubes irradiated by various ion species, Nanotechnology, 2009, 第 4 作者
(28) 单壁碳纳米管的直径和手征性对辐照稳定性的效应, Effects of tube diameter and chirality on the stability of single-walled carbon nanotubes under ion irradiation, JOURNAL OF APPLIED PHYSICS, 2009, 第 11 作者
(29) 一维电子系统中的线性光学响应:实验与理论的比较, Linear optical responses of one-dimensional electron systems:Comparison of theories with experiments, Physica E, 2008, 第 2 作者
(30) 量子线激光中增益峰的库仑增强与抑制, Coulomb Enhancement and Suppression of Peak Gain in Quantum Wire Lasers, Japanese Journal of Applied Physics, 2007, 第 1 作者
(31) 光激发半导体量子线的吸收与增益谱:库仑关联与屏蔽作用, Absorption and gain spectra of optically excited semiconductor quantum wires: Effects of Coulomb correlation and screening, Journal of Luminescence, 2006, 第 1 作者
(32) 双给体分子中电荷诱导自旋排列:多电子自旋关联系统的数值计算, Charge-induced spin alignment in diradical donor molecules: Numerical calculations of correlated many-electron-spin systems, THE JOURNAL OF CHEMICAL PHYSICS, 2005, 第 1 作者
(33) 分子磁体中自旋排列的光学与电荷控制, Optical and electronic control of spin-alignment in molecular magnets , Synthetic Metals , 2005, 第 1 作者
(34) 有机分子中光激发诱导高自旋态的理论, Theory of photoinduced high-spin states in organic molecules, Physical Review B, 2005, 第 1 作者
(35) 多烯分子磁体模型电荷掺杂高自旋态的理论, Theory of doping induced high-spin in a model of polyene-based molecular magnets, Journal of the Physical Society of Japan, 2004, 第 1 作者
(36) 分子磁体中自旋排列控制的理论研究, Theoretical study of spin-alignment control in molecular magnets, Current Applied Physics, 2004, 第 1 作者
(37) pi共轭分子磁体中基于电荷掺杂的自旋排列控制, Electronic control of spin alignment in pi-conjugated molecular magnets, Physical Review Letters, 2003, 第 1 作者
(38) pi共轭分子磁体的自旋排列理论, Theory of spin alignment in pi-conjugated molecular magnets, Synthetic Metals, 2003, 第 1 作者
(39) 光诱导相与热激发相的差异, Difference between photoinduced phase and thermally excited phase, Journal of the Physical Society of Japan, 2002, 第 1 作者
(40) 准一维电荷转移化合物TTF-CA中光诱导相变的理论, Theory of photoinduced phase transition in the quasi-one-dimensional charge transfer compound TTF-CA, International Journal of Modern Physics B, 2001, 第 1 作者
(41) 准一维有机分子晶体TTF-CA中光诱导离子-中性相变的理论, Theory for photoinduced ionic-neutral structural phase transition in quasi one-dimensional organic molecular crystal TTF-CA, Journal of the Physical Society of Japan, 2000, 第 1 作者