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浏览/检索结果: 共10条，第1-10条 帮助 限定条件 发表日期：2016     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序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 First-Order Symmetry Energy Induced by Neutron-Proton Mass Difference 期刊论文 CHINESE PHYSICS LETTERS, 2016, 卷号: 33, 页码: 4 作者:  Dong, Jian-Min;  Zuo, Wei;  Gu, Jian-Zhong 收藏  |  浏览/下载：15/0  |  提交时间：2018/05/31 Experimental and theoretical studies on the linear and nonlinear optical properties of lead phosphate crystals lipbpo4 期刊论文 Physical chemistry chemical physics, 2016, 卷号: 18, 期号: 28, 页码: 19123-19129 作者:  Han, Guopeng;  Liu, Qiong;  Wang, Ying;  Su, Xin;  Yang, Zhihua 收藏  |  浏览/下载：26/0  |  提交时间：2019/05/09 Compressional behavior of MgCr2O4 spinel from first-principles simulation 期刊论文 SCIENCE CHINA-EARTH SCIENCES, 2016, 卷号: 59, 期号: 5, 页码: 989-996 作者:  Zhang YanYao;  Liu Xi;  Xiong ZhiHua;  Zhang ZhiGang 收藏  |  浏览/下载：13/0  |  提交时间：2017/11/22 MgCr2O4 spinel  Compressional behavior  GGA  LDA  Polyhedral compressibility   Compressional behavior of MgCr_2O_4 spinel from first-principles simulation 期刊论文 Science China. Earth Sciences, 2016 Zhang Yanyao; Liu Xi; Xiong Zhihua; Zhang Zhigang 收藏  |  浏览/下载：2/0  |  提交时间：2017/12/03 MgCr_2O_4 spinel  Compressional behavior  GGA  LDA  Polyhedral compressibility  EARTHS UPPER-MANTLE  X-RAY-DIFFRACTION  AB-INITIO  OXYGEN GEOBAROMETER  CATION DISTRIBUTION  MINERAL INCLUSIONS  CHROMIAN SPINEL  PRESSURE  DIAMOND  TRANSITION   Exact two-component relativistic energy band theory and application 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2016 Zhao, Rundong; Zhang, Yong; Xiao, Yunlong; Liu, Wenjian 收藏  |  浏览/下载：5/0  |  提交时间：2017/12/03 PLANE-WAVE METHOD  DENSITY-FUNCTIONAL CALCULATIONS  GENERALIZED GRADIENT APPROXIMATION  POTENTIAL LCAO METHOD  ELECTRONIC-STRUCTURE  SILVER-HALIDES  CHEMISTRY  SOLIDS  MOLECULES  PRESSURES   The local projection in the density functional theory plus U approach: A critical assessment 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2016 Wang, Yue-Chao; Chen, Ze-Hua; Jiang, Hong 收藏  |  浏览/下载：4/0  |  提交时间：2017/12/03 STRONGLY CORRELATED SYSTEMS  NARROW ENERGY-BANDS  MEAN-FIELD THEORY  PLANE-WAVE BASIS  ELECTRONIC-STRUCTURE  LDA+U METHOD  SPECTRA  IMPLEMENTATION  INSULATORS  TRANSITION   First-principles study of relative stability of rutile and anatase TiO2 using the random phase approximation 期刊论文 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016 Cui, Zhi-Hao; Wu, Feng; Jiang, Hong 收藏  |  浏览/下载：2/0  |  提交时间：2017/12/03 DIELECTRIC-CONSTANT  PERTURBATION-THEORY  TRANSFORMATION  CRYSTAL  ENERGY  PHOTOCATALYSIS  POLYMORPHS  ENERGETICS  PRESSURE  EXCHANGE   Quantitative Interpretation of the Low-Bias Conductance of Au-Mesitylene-Au Molecular Junctions Formed from Mesitylene Monolayers 期刊论文 CHEMPHYSCHEM, 2016 Wang, Hao; Jiang, Zhuoling; Wang, Yongfeng; Sanvito, Stefano; Hou, Shimin 收藏  |  浏览/下载：2/0  |  提交时间：2017/12/03 density functional theory  molecular junctions  molecule-substrate interaction  non-equilibrium green&apos  scanning tunneling microscopy  VACUUM LEVEL SHIFTS  METAL-SURFACES  ELECTRONIC TRANSPORT  SINGLE MOLECULES  DEVICES  1ST-PRINCIPLES  ADSORPTION  BENZENE  STATES  APPROXIMATION  s function   Dynamic properties of the energy loss of multi-MeV charged particles traveling in two-component warm dense plasmas 期刊论文 PHYSICAL REVIEW E, 2016 Fu, Zhen-Guo; Wang, Zhigang; Li, Meng-Lei; Li, Da-Fang; Kang, Wei; Zhang, Ping 收藏  |  浏览/下载：3/0  |  提交时间：2017/12/03 RELAXATION-TIME APPROXIMATION  LINDHARD DIELECTRIC FUNCTION  STRONGLY COUPLED PLASMAS  STOPPING POWER  HEAVY-IONS  FUSION IMPLOSIONS  VELOCITY  SCATTERING  TARGETS   Accurate ionization potential of semiconductors from efficient density functional calculations 期刊论文 PHYSICAL REVIEW B, 2016 Ye, Lin-Hui 收藏  |  浏览/下载：3/0  |  提交时间：2017/12/04 PLANE-WAVE METHOD  ELECTRONIC-STRUCTURE  THIN-FILMS  BAND-STRUCTURE  EXCHANGE  MOLECULES  SYSTEMS  CHARGE