Dissertation 

About 35 item dissertation in line with Ab initio calculation query results,the following is 1 to 50(Search took 0.080 seconds)

  1. Adsorption and Dissociation of H2on Aluminum Cluster Anions Studied by Ab Initio Calculations,LiWenJie/Northwest Normal University,0/6
  2. Studies on Magnetism of Semiconductor and Ultiferroic Materials,ZhangYongJia/Shandong University,0/191
  3. First-Principles Caculations on Magnetism of Nanostructured Materials,LiuHua/Shandong University,0/147
  4. Ab Initio Calculation on Potential Energy Curves and Vibration-rotation Spectrum of Cl2+,GuoJing/Jilin University,0/26
  5. Ab Initio Study of He Point Defects in fcc Au-Ag Alloys,ZhuZiQiang/University of Electronic Science and Technology,0/2
  6. Scandium, yttrium, erbium metal hydrogen, helium behavior with density functional theory,ChenRuCheng/University of Electronic Science and Technology,0/54
  7. Theoretical Study of Halogen Bonding-A World Parallel to Hydrogen Bonding,LuYunXiang/Zhejiang University,2/441
  8. Construction and Application of N-body Potential in Binary and Ternary Transition Metal Systems,DaiXiaoDong/Tsinghua University,1/388
  9. Study on the Excited States of Several Molecular Systems: Potential Energy Surface Intersections and the Properties of the Organic Light-emitting Material,LiuXiaoJun/Shandong University,0/346
  10. The Electronic Structures and Transport Properties of Hole-doped LiCoO2 Materials,JinShengZhe/Jilin University,1/322
  11. Mass Analyzed Threshold Ionization Spectroscopy of Bromopropanes and Methylindoles,ZhangZuo/Wuhan Institute of Physics and Institute of Mathematics,1/54
  12. First-Principles Study of the ABO3-type Rare-Earth Transition-Metal Oxides,MengXing/Jilin University,6/448
  13. First-Principles Investigation on the Structures and Properties of LiMnO2 System,HuangZuFei/Jilin University,15/741
  14. Study of Alloy Phase Formation by Thermodynamics,Molecular Dynamics Simulation and Ion Beam Mixing,ZhangRuiFeng/Tsinghua University,0/681
  15. Theoretical Predictive Study on the Structures and Properties of Tri-s-triazines,ZhengWenXu/Sichuan University,1/495
  16. Research for the Surface Structure of Pt/C Catalyst and Its Activity to Hydrogen-water Isotopic Exchange Reaction,ZhongZhengKun/Chinese Academy of Engineering Physics,2/212
  17. First-principles Studies on the Electronic Structure and Properties of the Energy-Storage Materials,XuXiaoGuang/Jilin University,1/846
  18. The Nanosecond and Femtosecond Laser Photoionization and Initio Calculation Stndies of Some Hydrogen Bond Clusters,ZhangBaiLin/Dalian Institute of Chemical Physics,1/150
  19. Theoretical Studies on the Dihydrogen-bonded Complexes Containing Alkali Metal or Alkali-Earth Metal Hydrides,FengZuo/Jilin University,0/57
  20. Study of the Surface State and Energy Contain Property of Porous Silicon,ShiQiongLing/Chongqing University,1/124
  21. Quantum chemical study of the natural amino acid ion,LiXiaoFei/Zhengzhou University,0/87
  22. Ab Initio Study of the Hydrogen-covered Diamond (001) Surface,YuYang/Jilin University,0/217
  23. Alcohol - ether clusters multi-photon ionization mass spectrometry,WangYan/Qufu Normal University,0/23
  24. Theoretical Investigation on the Reaction Mechanism of Formaldehyde with OH~X(X=-1, 0, +1),ZhaoYuChao/Dalian Institute of Chemical Physics,0/91
  25. A Quantum Mechanics Investigation on the Structure and Performance of Dopped Spinel Maganese Oxide,NingLianCai/China University of Geosciences,0/382
  26. Types of benzo- heterocyclic compounds the second NLO and fluorescence properties,XieWeiJia/Nanjing Normal University,0/94
  27. Theoretical analysis based on the density functional theory Ni_3Al field ion microscope image,YangHaiBo/Hebei Normal,0/35
  28. The Study of Trimethylamine’s Photodissociation Mass Spectra,ZhaoShuYan/Qufu Normal University,0/14
  29. Acetone - water clusters multi-photon ionization mass spectrometry study,WangReng/Qufu Normal University,0/37
  30. Multiphoton Ionization Mass Spectrum of Ammonia-alcohol Hydrogen-bonded Cluster,XuMingKun/Qufu Normal University,0/32
  31. The Study of MPI-MS and Ab Initio Calculation of Alcohol Clusters,CaiTingDong/Qufu Normal University,1/21
  32. Raman spectra of silicate and aluminosilicate minerals,WangChen/Chinese Geology University (Beijing),0/588
  33. The Study of Properties and Technological Improvement of Chromium Oxide Green,WuYuQuan/Chongqing University,2/326
  34. O - bromotoluene and bromotoluene multiphoton ionization mass spectrometry,SongBao/Qufu Normal University,0/42
  35. Theoretical Calculation of Photodissociation of C2F5I,ZhaoShuTao/Jilin University,0/14

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