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在典型半金属及贵金属上的表面在位反应机理研究 学位论文
: 中国科学院大学(中国科学院上海应用物理研究所), 2020
Authors:  胡金棒
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表面在位反应  扫描隧道显微镜  吸附原子  DFT  光电子能谱  
石墨烯优化固体聚合物电解质电解法分离氢同位素的模拟分析 期刊论文
核技术, 2020, 卷号: 43, 期号: 10, 页码: 52-58
Authors:  卫飞;  唐方东;  刘佳煜;  忻智炜;  曾友石;  楚鑫新;  刘卫
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石墨烯  氢同位素分离  密度泛函理论(Density Functional Theory,DFT)  SPE电解法  分离系数  
High-Pressure Phase Transitions of Cubic Y2O3 under High Pressures by In-situ Synchrotron X-Ray Diffraction 期刊论文
CHINESE PHYSICS LETTERS, 2019, 卷号: 36, 期号: 4, 页码: —
Authors:  Jiang, S;  Liu, J;  Li, XD;  Li, YC;  He, SM;  Zhang, JC
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RARE-EARTH SESQUIOXIDES  AB-INITIO  TRANSFORMATION  CRYSTAL  DFT  
Infrared Spectroscopic and Theoretical Studies of Group 3 Metal Isocyanide Molecules 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 35, 页码: 7099-7106
Authors:  Chen, XT;  Li, QNA;  Andrews, L;  Gong, Y
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DENSITY-FUNCTIONAL CALCULATIONS  PURE ROTATIONAL SPECTRUM  GAUSSIAN-BASIS SETS  DFT CALCULATIONS  SOLID ARGON  MATRIX PREPARATION  TRANSITION-METALS  WAVE-FUNCTIONS  MH4-M  ATOMS  
A density functional theory study on the interaction between UO22+ and the carbamoylphosphoramidic acid ligand for uranium extraction from seawater 期刊论文
NUCLEAR SCIENCE AND TECHNIQUES, 2018, 卷号: 29, 期号: 6, 页码: -
Authors:  Guo, XJ;  Li, C;  Hu, JT;  Ma, HJ;  Qian, HL
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Ab-initio Pseudopotentials  Sequestering Uranium  Dft Investigations  Parameter Sets  Uranyl-ion  Energy  Complexes  Actinides  Potentials  Solvation  
Terahertz spectra of L-phenylalanine and its monohydrate 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 178, 页码: 19-23
Authors:  Pan, TT;  Li, SP;  Zou, T;  Yu, Z;  Zhang, B;  Wang, CY;  Zhang, JB;  He, MX;  Zhao, HW
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L-phenylalanine  Monohydrate  Terahertz Absorption Spectrum  Low-frequency Vibration  Dft  
Nanocrystalline iron-boron catalysts for low-temperature CO hydrogenation: Selective liquid fuel production and structure-activity correlation 期刊论文
JOURNAL OF CATALYSIS, 2016, 卷号: 339, 期号: -, 页码: 102—110
Authors:  Xu, K;  Cheng, Y;  Lin, J;  Wang, H;  Xie, SH;  Pei, Y;  Yan, SR;  Qiao, MH;  Li, ZH;  Zong, BN;  Qiao, MH (reprint author), Fudan Univ, Dept Chem, Collaborat Innovat Ctr Chem Energy Mat, Shanghai 200433, Peoples R China.;  Qiao, MH (reprint author), Fudan Univ, Shanghai Key Lab Mol Catalysis & Innovat Mat, Shanghai 200433, Peoples R China.;  Zong, BN (reprint author), SINOPEC, Res Inst Petr Proc, State Key Lab Catalyt Mat & Chem Engn, Beijing 100083, Peoples R China.
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Fischer-tropsch Synthesis  Fe  Adsorption  Dissociation  Activation  Surfaces  Coverage  Phase  Alloy  Dft  
Discovery of High-Pressure Polymorphs for a Typical Polymorphic System: Oxalyl Dihydrazide 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2015, 卷号: 119, 期号: 19, 页码: 10178—10188
Authors:  Tan, X;  Wang, K;  Yan, TT;  Li, XD;  Liu, J;  Yang, K;  Liu, BB;  Zou, GT;  Zou, B
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Hydrogen-bonded Solids  Infrared-spectra  Crystal  Exploration  Raman  Paracetamol  Acid  Urea  Dft  
FPGA在数字BPM信号处理器中的应用 学位论文
: 中国科学院研究生院, 2012
Authors:  赖龙伟
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Dbpm Fpga 软件无线电 下变频 Dft  
Differentiation of illicit drugs with THz time-domain spectroscopy 期刊论文
NUCLEAR SCIENCE AND TECHNIQUES, 2010, 卷号: 21, 期号: 4, 页码: 5
Authors:  Liu, GF;  Ma, SH;  Ji, T;  Zhao, HW;  Wang, WF;  Wang, WF (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China
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Terahertz  Thz-tds  Illicit Drugs  Dft  Morphine