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Theory and phenomenology for a variety of classical and quantum phase transitions 期刊论文
Journal of Mathematical Chemistry, 2013, 卷号: 51, 期号: 7, 页码: 1694-1711
作者:  N. H. March;  Z. D. Zhang
收藏  |  浏览/下载:106/0  |  提交时间:2013/12/24
Ising Model  Anderson Localization  Metal-insulator Transitions  Classical Phase Transitions  Quantum Phase Transitions  Laughlin  Electron Liquid  Wigner Electron Solid  Orthorhombic Ising Lattices  Recent Conjectured Solution  Vapor  Critical-point  Critical Exponents  Tetrahedron Equation  Integrable  Models  Metal-insulator  Order-disorder  3 Dimensions  Liquid  
Direct MP2 Molecular Dynamics Studies of H Atom Reaction with CD4 and CH4 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2011, 卷号: 111, 期号: 15, 页码: 4433-4442
作者:  Lu, Peng;  Kuang, Xiao-Yu;  Li, Hui-Fang;  Wang, Huai-Qian
收藏  |  浏览/下载:106/0  |  提交时间:2021/02/02
barrier height  electronic structure method  direct classical trajectory calculation  MP2/cc-pVDZ  BOMD  
Direct MP2 Molecular Dynamics Studies of H Atom Reaction with CD4 and CH4 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2011, 卷号: 111, 期号: 15, 页码: 4433-4442
作者:  Lu, Peng;  Kuang, Xiao-Yu;  Li, Hui-Fang;  Wang, Huai-Qian
收藏  |  浏览/下载:90/0  |  提交时间:2021/02/02
barrier height  electronic structure method  direct classical trajectory calculation  MP2/cc-pVDZ  BOMD  
Mechanical Properties of Bamboo-like Boron Nitride Nanotubes by In Situ TEM and MD Simulations: Strengthening Effect of Interlocked Joint Interfaces 期刊论文
Acs Nano, 2011, 卷号: 5, 期号: 9, 页码: 7362-7368
作者:  D. M. Tang;  C. L. Ren;  X. L. Wei;  M. S. Wang;  C. Liu;  Y. Bando;  D. Golberg
收藏  |  浏览/下载:114/0  |  提交时间:2012/04/13
Boron Nitride Nanotube  Interfacial Geometry  Mechanical Properties  In  Situ Tem  Md Simulation  Multiwalled Carbon Nanotubes  Computer Experiments  Classical Fluids  Tensile Tests  Composites  Nanocontacts  Nanowires  Resistant  Modulus  Growth  
Unattenuated conical spin wave in spiral magnet: The role of Dzyaloshinskii-Moriya interaction 期刊论文
Journal of Applied Physics, 2011, 卷号: 110, 期号: 5
作者:  Y. J. Guo;  Y. M. Tao;  X. Chen;  M. H. Qin;  S. Dong;  J. M. Liu
Adobe PDF(1035Kb)  |  收藏  |  浏览/下载:162/0  |  提交时间:2012/04/13
Classical Heisenberg-model  Ferromagnets  Mnsi  Phase  Order  
Direct MP2 Molecular Dynamics Studies of H Atom Reaction with CD(4) and CH(4) 期刊论文
International Journal of Quantum Chemistry, 2011, 卷号: 111, 期号: 15, 页码: 4433-4442
作者:  P. Lu;  X. Y. Kuang;  H. F. Li;  H. Q. Wang
Adobe PDF(448Kb)  |  收藏  |  浏览/下载:100/0  |  提交时间:2012/04/13
Barrier Height  Electronic Structure Method  Direct Classical Trajectory  Calculation  Mp2/cc-pvdz  Bomd  Initio Classical Trajectories  Abstraction Reaction Dynamics  Potential-energy Surfaces  Hessian-based Integrators  Born-oppenheimer  Surface  Photodissociation  Acetaldehyde  Excitation  Hydrogen  
A numerical study of grain size effects on the strength and elongation of Al polycrystals using strain gradient plasticity theory 期刊论文
International Journal of Materials Research, 2008, 卷号: 99, 期号: 2, 页码: 191-196
作者:  L. Zhou;  S. X. Li;  W. Ke
收藏  |  浏览/下载:143/0  |  提交时间:2012/04/13
Strain Gradient Plasticity  Classical Plasticity  Finite Element Method  Al polycrystAls  Size Effect  Matrix Composites  Particle-size  Length Scale  Aluminum  Deformation  Ductility  
Nature of the ferromagnetic behavior and possible occurrence of the ferrimagnetic phase transition in genuinely organic molecule-based assemblages with an S=1 and S=1/2 antiferromagnetic alternating spin chain: A Green's function approach 期刊论文
Journal of Physical Chemistry A, 2008, 卷号: 112, 期号: 27, 页码: 6205-6210
作者:  H. H. Fu;  K. L. Yao;  Z. L. Liu
Adobe PDF(200Kb)  |  收藏  |  浏览/下载:123/0  |  提交时间:2012/04/13
Nitrophenyl Nitronyl Nitroxide  Simple Classical Pictures  Numerical-calculations  Composite Molecules  Magnetic-properties  Building-blocks  Ground-state  Component  Model  System  
Simulation of effects of grain scale on Al polycrystal strength using strain gradient plasticity concept 期刊论文
ACTA METALLURGICA SINICA, 2006, 卷号: 42, 期号: 7, 页码: 781-784
作者:  Zhou Li;  Li Shouxin;  Ke Wei
收藏  |  浏览/下载:62/0  |  提交时间:2021/02/02
strain gradient plasticity  classical plasticity  finite element  Al polycrystal  scale effect  
TMRG studies on spin alignment in molecule-based ferrimagnetics 期刊论文
Physics Letters A, 2005, 卷号: 338, 期号: 3-5, 页码: 315-322
作者:  Q. M. Liu;  K. L. Yao;  Z. L. Liu
收藏  |  浏览/下载:71/0  |  提交时间:2012/04/14
Molecular Magnet  Spin Lattice Model  Renormalization Group Methods  Ferrimagnetics  Simple Classical Pictures  Crystal-structure  Breakdown  Chain