机构

• 物理研究所 [6]
• 金属研究所 [3]
• 福建物质结构研究所 [1]
• 化学研究所 [1]
• 半导体研究所 [1]

采集方式

• OAI收割 [12]

内容类型

• 期刊论文 [12]

发表日期

• 2011 [1]
• 2010 [3]
• 2009 [2]
• 2008 [2]
• 2006 [1]
• 2005 [1]
• 更多

学科主题

• 半导体物理 [1]

筛选

浏览/检索结果: 共12条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序作者升序作者降序 Mechanism Insights into Second-Order Nonlinear Optical Responses of Anionic Metal Clusters 期刊论文  OAI收割 Journal of Cluster Science, 2011, 卷号: 22, 期号: 3, 页码: 365-380 Q. H. Li; K. C. Wu; R. J. Sa; Y. Q. Wei 收藏  |  浏览/下载：93/0  |  提交时间：2012/06/06 Density functional calculations  Charge transfer  Metal-metal  interactions  Nonlinear optics  correct asymptotic-behavior  order regular approximation  density-functional theory  quadratic hyperpolarizability  correlation  energies  crystal-structure  screening model  nlo properties  electron-gas  complexes   Structures and absorption spectra of sulfur cluster S(9) via first-principles calculations 期刊论文  OAI收割 Physica B-Condensed Matter, 2010, 卷号: 405, 期号: 1, 页码: 148-152 J. Q. Lan; X. R. Chen; Y. L. Bai; J. Zhu 收藏  |  浏览/下载：25/0  |  提交时间：2012/04/13 Density-functional theory  Langevin molecular dynamics  Annealing  technique  Sulfur clusters  local-density approximation  electron-gas  ab-initio  ci method  time  pseudopotentials  spectroscopy  molecules   Cooperativity in Surface Bonding and Hydrogen Bonding of Water and Hydroxyl at Metal Surfaces 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY C, 2010, 卷号: 114, 期号: 22, 页码: 10240 Schiros, T; Ogasawara, H; Naslund, LA; Andersson, KJ; Ren, J; Meng, S; Karlberg, GS; Odelius, M; Nilsson, A; Pettersson, LGM 收藏  |  浏览/下载：33/0  |  提交时间：2013/09/17 RAY-EMISSION SPECTROSCOPY  DENSITY-FUNCTIONAL THEORY  INITIO MOLECULAR-DYNAMICS  NEAR-AMBIENT CONDITIONS  AB-INITIO  DISSOCIATIVE ADSORPTION  CORRELATION-ENERGY  CLUSTERS (H2O)(N)  CU(110) SURFACE  ELECTRON-GAS   Correcting the systematic error of the density functional theory calculation: the alternate combination approach of genetic algorithm and neural network 期刊论文  OAI收割 chinese physics b, CHINESE PHYSICS B, 2010, 2010, 卷号: 19, 19, 期号: 7, 页码: art. no. 076401, Art. No. 076401 作者:  Wang TT (Wang Ting-Ting);  Li WL (Li Wen-Long);  Chen ZH (Chen Zhang-Hui);  Miao L (Miao Ling);  Chen, ZH, Chinese Acad Sci, Inst Semicond, State Key Lab Superlattices & Microstruct, Beijing 100083, Peoples R China. 电子邮箱地址: zhanghuichen88@gmail.com   |  收藏  |  浏览/下载：105/1  |  提交时间：2010/08/17 density functional theory  Density Functional Theory  Neural Network  Genetic Algorithm  Alternate Combination  Linear-regression Correction  Training Set  Electron-gas  Prediction  Approximation  Descriptors  Accurate  Energy  Heat  neural network  genetic algorithm  alternate combination  LINEAR-REGRESSION CORRECTION  TRAINING SET  ELECTRON-GAS  PREDICTION  APPROXIMATION  DESCRIPTORS  ACCURATE  ENERGY  HEAT   Direct Visualization of the Chemical Mechanism in SERRS of 4-Aminothiophenol/Metal Complexes and Metal/4-Aminothiophenol/Metal Junctions 期刊论文  OAI收割 CHEMPHYSCHEM, 2009, 卷号: 10, 期号: 2, 页码: 392 Sun, MT; Xu, HX 收藏  |  浏览/下载：33/0  |  提交时间：2013/09/17 ENHANCED RAMAN-SCATTERING  DENSITY-FUNCTIONAL THEORY  INHOMOGENEOUS ELECTRON-GAS  CHARGE-TRANSFER  P-AMINOTHIOPHENOL  SILVER ELECTRODE  SURFACE  SPECTROSCOPY  SPECTRA  GOLD   DFT study of adsorption site effect on surface-enhanced Raman scattering of neutral and charged pyridine-Ag-4 complexes 期刊论文  OAI收割 SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2009, 卷号: 73, 期号: 2, 页码: 382 Liu, SS; Zhao, XH; Li, YZ; Chen, MD; Sun, MT 收藏  |  浏览/下载：33/0  |  提交时间：2013/09/17 DENSITY-FUNCTIONAL THEORY  INHOMOGENEOUS ELECTRON-GAS  RHODAMINE 6G  CHEMICAL MECHANISM  ABSORPTION-SPECTRA  SILVER ELECTRODE  AB-INITIO  SPECTROSCOPY  CLUSTERS  MOLECULES   Assessment of density functionals for the investigation of iridium(III) complexes 期刊论文  OAI收割 JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2008, 卷号: 861, 期号: 1-3, 页码: 97-102 作者:  Nie, Daobo;  Liu, Zhiwei;  Bian, Zuqiang;  Huang, Chunhui   |  收藏  |  浏览/下载：19/0  |  提交时间：2019/04/09 Iridium Complexes  Density Functional Theory  Uniform Electron Gas Limit   Theoretical study on SERRS of rhodamine 6G adsorbed on Ag-2 cluster: chemical mechanism via intermolecular or intramolecular charge transfer 期刊论文  OAI收割 JOURNAL OF RAMAN SPECTROSCOPY, 2008, 卷号: 39, 期号: 9, 页码: 1170 Liu, SS; Wan, SB; Chen, MD; Sun, MT 收藏  |  浏览/下载：26/0  |  提交时间：2013/09/23 ENHANCED RAMAN-SCATTERING  INHOMOGENEOUS ELECTRON-GAS  DENSITY-FUNCTIONAL THEORY  SILVER ELECTRODE  SPECTROSCOPY  MOLECULES  APPROXIMATION  NANOPARTICLES  PYRIDINE  SPECTRA   Investigations of the spin Hamiltonian parameters and defect structure for the rhombic Gd3+ center in calcium oxide 期刊论文  OAI收割 Radiation Effects and Defects in Solids, 2006, 卷号: 161, 期号: 9, 页码: 505-510 S. Y. Wu; H. N. Dongo; J. Z. Lin; Q. Fu 收藏  |  浏览/下载：28/0  |  提交时间：2012/04/14 superposition model  defect structures  crystal fields and spin  Hamiltonians  Gd3+  CaO  electron-gas theory  single-crystals  superposition-model  energy  levels  cao  ions  resonance  epr  gadolinium  coatings   Rashba spin-orbit coupling effect on the noise in quasi-one-dimensional nanowires under an applied magnetic field 期刊论文  OAI收割 PHYSICAL REVIEW B, 2005, 卷号: 72, 期号: 7 Li, YX; Guo, Y; Li, BZ 收藏  |  浏览/下载：33/0  |  提交时间：2013/09/24 SCATTERING-THEORY  INVERSION-LAYERS  ELECTRON-GAS  CONDUCTORS  CONSTRICTION  ADMITTANCE  TRANSPORT  INAS