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Keyword [Density Functional Theory]
Result: 61 - 80 | Page: 4 of 10
61. Metal Nano-hole Array Copied From AAO Template And Raman Experimental And DFT Theoretical Studies On The States Of Substances In Solution
62. Properties Of Diluted Magnetic Semiconductor: First-principles Calculations
63. First-principles Study Of The Single-bonded Cubic Phase Of Nitrogen
64. An Experimental And Theoretical Study On The Adsorption Behaviors Of Molecules On Silver Nano-particles
65. The Study Of Physical Properties Of Iron Under High Pressure And High Temperature
66. The Research On The Microarrangments Of Hydrogen In LaNi4.5Al0.5Hx Crystal
67. Adsorption Behavior Of Impurity Gas On Pd Alloy Surface
68. First-Principles Studies Of P-type Doping In ZnO
69. Energy Band Structures And Properties Of Electric Materials By DFT Studies
70. Study Of Energy And Electronic Properties In Semiconductor Quantum Dots
71. Study Of The Geometric And Electronic Structures Of Oxide-diluted Magnetic Semiconductors
72. First-principles Study Of Cadmium Sulfide Clusters And S Doped Wurtzite ZnO
73. Theoretical Study Of Li-doped Be_N And Ni-doped B_N Clusters
74. Density Functional Theory Study Of The Organic Molecules-PTCDA/ME-PTCDI And Molecular-dynamics Simulation With The EAM
75. First Principles Study Of The Ground-state Structures Stability As Well As Magnetism Of Zr_n, Zr_nFe Clusters
76. Investigation Of FeB_N(N=1-10) Clusters By Using Density Functional Theory
77. Theoretical Investigation On Dissociation Mechanism Of The Ionized Cyclohexanone In Excited States
78. Research On The Structural And Electronic Properties Of Ga_n,Ga_nN,In_n Clusters
79. Classical And Ab Initio Molecular Dynamics Study Of The Catalytic Core Of Kinesin
80. Geometric And Electronic Structures Of Noble-metal-based Clusters
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