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Keyword [Density functional theory]
Result: 181 - 200 | Page: 10 of 10
181.
The Investigations Of Mechanical-Electronic-Magnetic Coupling In Low-Dimensional Zinc Oxide And Graphene Nanostructures
182.
Theoretical Study On Several Important Reactions Catalyzed By Gold-based And Platinum-based Catalysts
183.
The Isotactic Polystyrene High Vacuum Anionic Synthesis And Its Integration Rubber,
184.
Bi-functional Organic Small Molecule Catalytic Asymmetric Synthesis Reactions Theoretical Research
185.
Disproportionation Reaction Of Chloride. Alumina Vacuum Carbothermal Reduction Theory
186.
Density Functional And Ab Initio MO Study On The Electrionic Structure And Carbonyls' Fluxionality Of The Triosmium Carbonyl Clusters
187.
Theoretical Studies Of The Mechanism Of Nh2 And Ch4
188.
Theoretical Study Of The Electronic Spectrum Property Of Organic Metal Complex With 2-(2-hydroxyphenyl) Pyridine Ligand
189.
Density Functional Theoretical Studies On The Electronic Structure And Properties Of The Ligand-Free Transition-Metal Clusters
190.
Studies On The Bounds To Density Functionals For Molecules In Density Functional Theory
191.
A DFT Study Of The Electronic Properties And Relative Stability On [H
n
P
2
Mo
5
O
23
]～((6-n)-) And α/β-Keggin [SiW
9
Al
3
(H
2
O)
3
O
37
]～(7-) Polyan
192.
Theoretical Investigation Of GeSiC Ternary Semiconductor Microcluster
193.
Quantum Chemistry Research On The Structures And Properties Of Adamantane And Tetrahedrane Energetic Derivatives
194.
Mechanism Of The Hydrogenation Of α, β-Unsaturated Aldehyde
195.
Synthesis And Research On The Properties Of AZOPA
196.
A Density Functional Investigation Of Nickel Doped Silicon Cluster
197.
Study Of Reaction Between CIONO～2 And CI～- On Ice Surface
198.
Theoretical Study On The Bimolecular Nucleophilic Substitution Reaction At Nitrogen
199.
A Theoretical Study On The Hydrogen Bond Properties In Polyglycine Peptides
200.
A Hybrid Cylindrical Model For Characterization Of MCM-41 By The GCMC Method And Density Functional Theory
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