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Keyword [density functional]
Result: 181 - 200 | Page: 10 of 10
181.
The Theoretical Prediction Of Isomers And Infrared Spectrum Of Interstellar Molecule SiC
4
H
182.
Density Functional Theory Studies On The Structures And Electronic Properties Of Mo And Mo
2
N Clusters
183.
Density Functional Theory Study For The Charged Hard Sphere Fluids
184.
Density Functional Theory Study Of Hydrogen Adsorption On Ti(0001) Surface
185.
The Theoretical Study On Structure And Properties Of Energetic Solid TATB Under Extreme Condition
186.
Electronic Structure And Characteristics Of Bent Graphene
187.
Density Functional Theory Study The Electrical And Optical Properties Of Graphene Doped With Pd
188.
A Theoretical Study On The Structures, Properties Of Pt_n Clusters And The Adsorption Of Gas Molecule On Them Under External Electric Field
189.
A Systematic Study Of Even-even Nuclei From Ne To Ca In Covariant Density Functional Theory With Triaxiality
190.
Electronic Properties Of Graphene Antidot Lattices And MoS
2
Nanoribbon
191.
Effect Of Co、Zn And Al Doping On The Structural And Properties For Multiferroic GaFeO
3
192.
Theoretical Research On The Structures And Spectral Properties For Ti
n-m
Zr
m
O
2n
（n=2-7,0≤m≤n） Clusters
193.
The Hybrid Density Functional Theory Study Of Wurtzite Semiconductors Under High Pressure
194.
First-principles Study On The Electronic Structures And Optical Properties Of Non-centrosymmetric Superconductors Y
2
C
3
、Li
2
Pd
3
B And Li
2
Pt
3
B
195.
The Noncollinear Magnetism Of Small Size Alloying Cluster And One Dimensional Atomic Chain
196.
The Structure And Characteristics Of Photocatalytic In TiO
2
:the First Principle Study
197.
Transition Metal Doping Effect On Strontium Titanate Electronic Structure And Optical Properties
198.
Research On Bio-molecules Based On Terahertz Spectroscopy And Density Functional Theory
199.
Theoretical Studies Of The Structures And Magnetic Properties On Platinum Doped Manganese And Aluminium Doped Niobium Clusters
200.
Density Functional Theory Studies On The Electronic Structures And Optical Properties Of Chalcopyrite Ternary Compounds
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