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Keyword [density functional theory (DFT)]
Result: 181 - 200 | Page: 10 of 10
181.
Studies On The Reaction Mechanisms Of Singlet Oxygen Damage To2’-deoxyguanosine And8-oxo-deoxyguanosine
182.
Electronic Structures And Optical Properties Of Metal(Cu,Ag,Au):MgF2Crystal
183.
DFT Study On The Mechanisms Of Cyclization Catalyzed By Siver And Platinum Complexes
184.
Structure-activity Relationship Studies On Polyhydroxylated Xanthones
185.
Theoretical Investigations On Structures And Properties Of B-H And B-Au Binary Clusters
186.
Study On The Mechanism Of Reforming Between Ethane And Supercritical Carbon Dioxide Over Ni-based Catalysts
187.
DFT Study On The Mechanisms Of Catalytic Alkynes Reactions Catalyzed By Copper, Silver And Palladum Complexes
188.
Theoretical Studies Of The Catalytic Mechanism Of The Glutamate Decarboxylase And Adenosine2503Methyltransferase
189.
Theoretical Investigation On The Reaction Mechanism Of Domino Reaction Catalyzed By Cu(Ⅰ)
190.
Desity Functional Theory Study Of Iron And Manganese Oxides Solid And Surface Adsorption Of NO_x
191.
Theoretical Study For The Reaction Of N12o （x
1
Σ
+
） With Co （
1
Σ
+
） Catalyzed By IrO
n
+
（n=1,2） And The Oxidization Reaction Of Nh
3
Catalyzed By Fe
+
in The Prese
192.
The DFT Study On C-C And C-H Bond Activated By Transition Metal
193.
A Density Functional Theory Study Of The Spin-forbidden Reactivity Of The Activation Of C
2
H
4
by Transition Metal
194.
First-principle Study On The Structure And Properties Of The Pt-alloy Clusters And Monolayer Anatase TiO
2
（001） Nanosheet
195.
Study On The Phthalate Contaminants In Food Package By Raman And Surface Enhancement Raman Spectroscopy
196.
A Density Functional Theoretical Study Of The Spin Forbidden Reactivity Of The Activation Of NH
3
and Circularly Catalyzed N
2
O/CO Molecules By Lanthanides Transition Metal In The Gas-phase
197.
Reaction Mechanism In Gas Phase Of Theoretical Study On The Transition-metal Sufide Cations With COS
198.
Theoretical Studies Of The Acidity Of Cation-exchanged Y And Its Adsorption Desulfurization
199.
Theoretical Study On The Redox Properties Of Lindqvist And Keggin-type Polyoxometalates
200.
The Theoretical Study On The Electronic Structures And Nonlinear Optical Properties Of Lindqvist-and Wells-Dawson-type Polyoxometalates
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